VMD-L Mailing List
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Starting: Thu Dec 19 1996 - 11:40:41 CST
Ending: Thu Apr 17 2025 - 01:02:05 CDT
- $B:,>k(J $B6Q(J
- Chavent Mathieu
- Y. U. Sasidhar
- #ANG YUN MEI ELISA#
- #WONG CHEE HOW#
- #YEO JINGJIE#
- .
- . Juita
- 04215287d_at_polyu.edu.hk
- 1(484)993-7152 Marty
- 16.zdsmith_at_gmail.com
- 3D SIG
- May 18th, Late abstract submission deadline for 3Dsig Structural Bioinformatics & Computational Biophysics (Wed May 11 2011 - 16:57:22 CDT)
- _at_huji.ac.il
- a a
- A D
- A. Gomez-Sicilia
- A. M. Carmen Prez
- A. M.M
- AA
- Aaron Blanchard, Ph.D.
- Aaron Larsen
- Aaron Oakley
- Aaron Taudt
- Aaron.Oakley_at_csiro.au
- Aashish Bhatt
- AB
- ABEL Stephane
- ABEL Stephane 175950
- RE: Plot the value of the current frame in the Progress Bar for elapsed Time (Thu Dec 02 2010 - 12:15:22 CST)
- Abhijit Ghosh
- Abhijit Muley
- Abhik Ghosh Moulick
- abhik.ghosh_at_bose.res.in
- Abhishek Bagusetty
- ABHISHEK GUPTA
- RE: How to draw a box in VMD and plot the coordinates of the system (Mon Mar 28 2016 - 00:50:24 CDT)
- Abhishek TYAGI
- Abi Ghanem josephine
- abinayar_at_imsc.res.in
- Abolfazl Bayat
- Abolfazl Musavi
- Abramyan, Tigran
- Abu Naser
- accomp lin
- accutone_at_atlsky.com
- Achar, Sid
- achchirangeebi
- Ackad, Edward
- Ada Zhan
- Adam Brenner
- Adam Goler
- Adam Gross
- Adam Kells
- Adam Kraut
- Adam Kubach
- Adam Marcus
- Adam Matěj
- Adelene Sim
- Adelman, Joshua Lev
- adil mughal
- Adilah Hussien
- Aditi Gotkhindikar
- Aditya Padhi
- Adkins, Laura R
- Adrain Koh
- Adrian E. Roitberg
- Adrian Jasiski
- Adrian Kaats
- Adrian Koh
- Adrian Roitberg
- Adrian turjanski
- Adriano Santana Sanchez
- Adupa Vasista
- Re: namd-l: Pair interaction calculation is not supported in CUDA version (Sun Mar 15 2020 - 23:48:52 CDT)
- Afnan Sultan
- Afroditi Maria Zaki
- Agarwal, Silvi
- Agarwal, Silvi
- Agnieszka Sobkiewicz
- agustina_at_cabm.rutgers.edu
- Ahmad Alqaisi
- Ahmed Nawar
- ahmed sengab
- Ahmet Bakan
- Ahmet yldrm
- ailong
- Aishwarya Smriti
- Aiswarya
- Aiswarya Pawar
- Aitor Gonzalez
- aizoon_at_gmx.net
- Ajasja Ljubetič
- Re: any way to rotate and translate with mouse without changing modes? (Tue Jun 24 2014 - 15:37:39 CDT)
- Re: Scripting API: are arguments to representation types documented somewhere? (Mon Aug 20 2012 - 07:34:55 CDT)
- Re: VMD never finishes reading vis. state file, stalls and hoggs CPU (Fri Nov 25 2011 - 05:05:32 CST)
- Does this work with VMD: Nvidia 3DVision Glasses + SyncMaster 2233RZ + GTX 580 + Win7? (Sat Jul 09 2011 - 17:06:19 CDT)
- Re: VMD does not exit after running closest.tcl script in combination with bigdcd (Tue Jun 07 2011 - 09:02:10 CDT)
- Re: VMD does not exit after running closest.tcl script in combination with bigdcd (Tue Jun 07 2011 - 09:07:08 CDT)
- Re: trying to combine closewater.tcl with bigdcd.tcl error frame 3 out of range for molecule 0 (Wed May 25 2011 - 05:57:10 CDT)
- Re: trying to combine closewater.tcl with bigdcd.tcl error frame 3 out of range for molecule 0 (Tue May 24 2011 - 12:22:00 CDT)
- Re: trying to combine closewater.tcl with bigdcd.tcl error frame 3 out of range for molecule 0 (Tue May 24 2011 - 09:48:15 CDT)
- Re: PhD position in Computational Structural Biology at MPI Muenster (Fri May 13 2011 - 07:04:26 CDT)
- Ajasja Ljubeti
- Ajeeta kaushiki
- Ajith Gunaratne
- Ajith Rathnaweera Rajapaksha Mudalige
- Akash Banerjee
- Akash Mondal
- Akash Pandya
- Akemi Matsuno-Yagi
- Akemi Yagi
- Akif Ramzan
- Akiyama, Jotaro
- Akshata Rudrapatna
- Akshay Bhatnagar
- Akshay Patny
- Al Courey
- Al-Ali, Hassan
- Al-Rawi, Ahlam
- alamng_at_uci.edu
- Alan
- Alan Wilter Sousa da Silva
- alarcon_at_lncc.br
- Alba Colet Subirachs
- Albers, Thomas
- Albert
- albert albert
- Albert Solernou
- Albert Sun
- alberto
- alberto baldelli
- Alberto Perez
- Alberto Sergio Garay
- Alberto Torres
- aldo jongejan
- Ale Gomez
- Alec Robertson
- Alec Zander
- Alejandro Ortega
- Aleksander Debinski
- Aleksandr Kivenson
- Aleksei
- Aleksei Aksimentiev
- Alessandro Cembran
- Alessandro Mariani
- Alessandro Mascioni
- Alessandro Ruda
- Alessandro.Maiorana_at_roma2.infn.it
- Alessio Alexiadis
- Alex Angerhofer
- Alex Blayney
- Alex Hahn
- Alex Hummels
- alex lin
- Alex Liu
- Alex Nazlidis
- Alex Peralvarez Marin
- Alex Richards
- Alex Saad-Falcon
- Alex Sha
- Alex Vakhrouchev
- Alexander A. Vakhrushev
- Alexander Adams
- Alexander Balaeff
- Alexander Beerhoff
- Re: can't build VMD on MacOs Ventura: use of undeclared identifier 'msms' (Tue Mar 07 2023 - 19:55:15 CST)
- can't build VMD on MacOs Ventura: use of undeclared identifier 'msms' (Tue Mar 07 2023 - 08:56:42 CST)
- Alexander Farley
- Alexander Howard
- Alexander Metz
- Alexander Peyser
- Alexander Spaar
- Alexandr Bezginov
- Alexandr Isayev
- Alexandr Kornev
- Alexandra Ringsby
- alexandra.marques_at_fc.up.pt
- Alexandre A. Vakhrouchev
- Alexandre Barrozo
- Alexandre PERRET
- Alexandre Suman de Araujo
- Re: Question about FFTK charge optimization procedure to CGENFF modeling (Tue May 14 2013 - 08:12:10 CDT)
- Question about FFTK charge optimization procedure to CGENFF modeling (Fri May 03 2013 - 15:40:41 CDT)
- Alexandre Suman de Araújo
- Alexandre Vakhrouchev
- Alexe Bojovschi
- Alexei Podtelezhnikov
- Alexei Rossokhin
- Alexey Kozlenkov
- Alexis Salas
- Alfred Shaohui Zheng
- Alfredo Quevedo
- Alfredo Valles
- Ali Ahmed
- Ali Alizadeh
- Re: Webinar on VMD's use of GPUs to accelerate MD visualization and analysis (Mon Feb 24 2014 - 10:07:36 CST)
- Ali Deyhim
- Ali Khanlarkhani
- Ali Morshedi
- Ali Osman Acar
- Ali Sheikholeslam
- Ali, Rejwan
- ali.kamrani91_at_REMOVE_yahoo.com
- Aliakbartehrani Zahra
- Aliasghar Alizadeh-Mojarad
- Alicia Hopkins
- Alilovic,Kata
- Alin Marin Elena - UKRI STFC
- Alin-Marin Elena - STFC UKRI
- Alisha \
- Alison Grinthal
- ALIYUN
- Allen, Caley R
- Re: FATAL ERROR: UNABLE TO FIND DIHEDRAL PARAMETERS FOR NH3 CT1 CT2A CT2 (ATOMS 1 5 7 10) (Mon Jan 27 2014 - 12:32:45 CST)
- Allison Rossetto
- Allison, Jane
- Almeida-Hernndez, Yasser, Dr.
- Almira Ovagimyan
- Althea Lake
- Alvea Tasneem
- Amadeu
- Amali Guruge
- Aman Jindal
- Amanda Jenkins
- Amarda Shehu
- Amaury Pupo Merio
- Amendra Fernando Hewa Dewage
- Ameya Harmalkar
- Amin Koochaki
- amin sagar
- amin_at_imtech.res.in
- Amir
- Amir Afshar
- Amir Hajiahmadi Farmahini
- Amir Hossein Saeedi Dehaghani
- Amir Suhail
- Amir Zeb
- Amira Yu
- amirhossein taghavi
- Amit
- amit dong
- Amit Gupta
- Amit Jaiswal
- amit kunte
- Amit Paliwal
- amit_at_mbu.iisc.ernet.in
- Amnah Alalmaie
- amodzelewska_at_dns.iimcb.gov.pl
- amodzelewska_at_iimcb.gov.pl
- Amor San Juan
- Amr Rizq
- Amrit Kalra
- Amy Rice
- Ana Celia Araujo Vila Verde
- script to load dcds from Replica Exchange simulations by Temperature (Mon Jan 15 2007 - 17:30:44 CST)
- RE: imposing period boundary conditions in a simulation with a crystal (Wed Sep 06 2006 - 08:31:59 CDT)
- the crystal structure of gold: questions about making the psf and about visualization in VMD; update (Tue May 23 2006 - 14:47:00 CDT)
- Ana Celia Vila Verde
- Ana Clia Vila Verde
- Ana Vila Verde
- Anand Kaushal
- Ananya Nayak
- Ananyo Bandyopadhyay
- anas forum
- Anatoliy
- Anatoly Chernyshev
- Anders Gabrielsson
- Andras Borosy
- andras.borosy_at_givaudan.com
- Andre Farias de Moura
- andre padilla
- andrea
- Andrea Bernini
- Andrea Carotti
- Andrea Cristiani
- Andrea Holfelder
- Andrea Kirkpatrick
- Andrea Spitaleri
- Re: Accessing tachyon optix from commandline and dat file generation (Tue Apr 04 2017 - 05:04:45 CDT)
- Re: Accessing tachyon optix from commandline and dat file generation (Mon Apr 03 2017 - 02:36:37 CDT)
- Andrea.Cristiani_at_pharm.unige.ch
- Andreas Kukol
- Andreas Tosstorff
- Andreas Wagenmann
- Andrei A Golosov
- Andrei Tudor
- Andrej Tekel
- Andres Bynum
- Andres Morales
- Andres Morales N
- Andres Palencia
- Andrew
- Andrew Dalke
- Re: What's the main reason of the structure or function of a protein? (Thu Mar 06 2008 - 00:25:03 CST)
- Andrew DeYoung
- Why are all carbon atoms lumped into C in the Name category in the colors dialog? (Fri Nov 29 2013 - 11:37:41 CST)
- Using Dipole Moment Watcher with Gromacs configurations and trajectories (Sat May 26 2012 - 12:20:09 CDT)
- Making only a subset of atoms transparent (or otherwise non-emphasized) (Tue May 15 2012 - 12:49:22 CDT)
- Andrew Doig
- Andrew Fenley
- Andrew Gormanly
- Andrew Hall
- Andrew Huang
- Andrew James Bennett
- Andrew Jewett
- Re: Feedback wanted from Linux VMD users with ATI/AMD graphics chipsets (Thu Nov 03 2011 - 15:56:37 CDT)
- Andrew M. Simms
- RE: mol urlload -- this doesn't seem to work in Windows (it does seem to work from Linux) (Fri Apr 16 2010 - 18:18:16 CDT)
- Andrew Petersen
- andrew ritchie
- Andrew Watts
- Andrew White
- Andrews, Casey
- Andrs Morales
- Re: Average angle between the lipid dipole vector and the bilayer normal. (Wed Apr 11 2012 - 16:43:01 CDT)
- Average angle between the lipid dipole vector and the bilayer normal. (Mon Apr 09 2012 - 12:55:17 CDT)
- Andy Lam
- Andy Liu
- aneamtu_at_iasi.mednet.ro
- aneesh cna
- angad sharma
- Angana Ray
- angel
- angel_at_cbuc.cl
- Angelo R. Rossi
- Angelo Rossi
- angelo vargas
- Anil Kumar
- Anirban Ghosh
- Anirudh Nandakumar
- Anjali Patel
- Anjela Manandhar
- AnkiReddy katha
- Re: fftk optimization of bonded parameters + Error: missing close-bracket (Thu Oct 31 2013 - 03:20:50 CDT)
- fftk optimization of bonded parameters + Error: missing close-bracket (Wed Oct 30 2013 - 03:08:57 CDT)
- Re: FFTK, pyrrolidine parametrization bonded parameters- issue with Hessian (Tue Oct 22 2013 - 06:59:59 CDT)
- ankit agrawal
- Anna
- Anna Aagaard
- Anna Amat
- Anna Battisti
- Anna Ceguerra
- Anna Karawajczyk
- Anna Kuznetsova
- Anna Lohning
- Anna Modzelewska
- Anna Petroff
- Anna Whitney
- Annabelle Posey
- annalisa_at_biotec.tu-dresden.de
- Anne Dara Bowen
- Anne Laustsen
- Anneta Tzampazi
- Annika Wittenbecher
- Anoop Krishnan
- anshudx_at_indiatimes.com
- Anshul Shah
- Anssi Nurminen
- Anthony Cruz
- Anthony Cruz Balberdi
- Anthony Cruz-Balberdy
- Anthony Ivetac
- Anthony Ma
- Anthony Rey
- Anthony Ruth
- Anthony Samiotakis
- Anton Arkhipov
- Re: Can the CG model built from VMD be used as an Input of NAMD,GROMACS and any other MD program? (Tue Apr 28 2009 - 10:34:04 CDT)
- Anton B. Guliaev
- Antonija Tomić
- Antonija Tomi
- Antonio Tilocca
- anu chandra
- anupama sharma
- Anuradha Mittal
- ANURAG JHA
- Anurag Sethi
- Anurag Sharma
- Anwaar Al-Zireeni
- anyy zsj
- apeyser_at_newssun.med.miami.edu
- aramice Malkhasian
- Arango, Andres Santiago
- Arash Azari
- Arash Firouzbakht
- aravind chandrasekaran
- Aravind Ravichandran
- Aravinda Munasinghe
- Araz Jakalian
- Archana Sonawani-Jagtap
- Ardavan Mehdizadeh
- Ardy Davari
- Aref Takiden
- Arent, Michael
- Arham Amouie
- Ari Turpeinen
- Arian Arian
- Aric Newton
- Arieana Moore
- Ariel Mitchell
- Arienti, Marco UTRC
- Arijit Ghosh
- Arindam Ganguly
- Aris Marcolongo
- Arjun Sharma
- Armando Jerome de Jesus
- Armen Nalian
- Arnab Chakrabarty
- Arnab Mukherjee
- Arneh Babakhani
- Re: Changing the Index values of a molecule (the differenece between gro and pdb files) (Wed Aug 15 2007 - 13:06:17 CDT)
- Changing the Index values of a molecule (the differenece between gro and pdb files) (Wed Aug 15 2007 - 12:39:08 CDT)
- Re: Using VMD just to plot some coordinates from a mathematical/geometrical model (Sat Jun 23 2007 - 10:29:11 CDT)
- Re: Using VMD just to plot some coordinates from a mathematical/geometrical model (Fri Jun 22 2007 - 20:04:40 CDT)
- Using VMD just to plot some coordinates from a mathematical/geometrical model (Fri Jun 22 2007 - 17:51:35 CDT)
- Re: Error while running scripts: terminate called after throwing an instance of 'std::bad_alloc' (Mon Feb 05 2007 - 10:59:04 CST)
- Re: Error while running scripts: terminate called after throwing an instance of 'std::bad_alloc' (Sun Feb 04 2007 - 21:58:19 CST)
- Re: Error while running scripts: terminate called after throwing an instance of 'std::bad_alloc' (Fri Feb 02 2007 - 20:04:29 CST)
- Arno Proeme
- Aronica, Pietro
- Arpita Srivastava
- Arsene Marian Alain
- Artem Mamonov
- Arthur Oliveira Vale
- Arthur Pereira da Fonseca
- Arthur Vale
- Artur Duque Rossi
- Artur Hermano
- Arturas
- Arturas Ziemys
- Arturo Fernandez
- Arun Krishnan
- arun kumar
- Arusha Acharyya
- Aryan Vahedi
- Aryan Vahedi-Faridi
- Asaf Farhi
- Asfa Ali
- Asghar Razavi
- Ash Johnson
- Ashar Malik
- Re: Creating PDB files of binding pockets that lists ligands first within the file (Tue Feb 02 2021 - 19:22:51 CST)
- Re: Questions about using VMD to modify/alter nucleic acid structures (Mon Sep 14 2020 - 03:48:25 CDT)
- Re: Create Binding Pocket of Every PDB File In A Directory Using TCL Scripts and Atomselect Command protein and within 4 of resname LIG (Mon Jul 20 2020 - 16:06:03 CDT)
- Re: Phi and Psi angles for particular residues as a function of time (Tue Jul 14 2020 - 11:27:50 CDT)
- Re: Using RMSD for individual residues script (as seen in the NAMD tutorial) and bigdcd (Mon Dec 09 2019 - 21:43:23 CST)
- Re: calculating number of water and osmolytes molecules at particular distance from protein surface. (Thu Jan 31 2019 - 00:00:10 CST)
- Re: Atomselection with the position selected conditions inside the loop is not working properly (Thu Aug 16 2018 - 11:22:21 CDT)
- Re: Atomselection with the position selected conditions inside the loop is not working properly (Thu Aug 16 2018 - 08:43:50 CDT)
- Re: Atomselection with the position selected conditions inside the loop is not working properly (Thu Aug 16 2018 - 06:50:38 CDT)
- Re: problem with mol IDs when running script from same VMD session. (Sun Jun 03 2018 - 14:29:11 CDT)
- Re: i thought I could run a 100 ns NAMD simulation in my laptop for a protein-hormone system containing around 2000 atoms in its pdb file(4lnx.pdb). But even to run a simulation for four hundred fifty thousand steps, it has taken almost 4700 minutes. is this normal or its low? the device has 4 cores with 16 gigs of ram and 4 gigs of gpu(amd). Or any suggestions to run it faster??? (Sun Mar 25 2018 - 20:44:48 CDT)
- Re: Decompose Transformation Matrix to Rotations and Translations along XYZ axes (Wed Mar 21 2018 - 13:29:17 CDT)
- Re: How to copy/paste a membrane patch to create a larger membrane? (Mon Feb 05 2018 - 10:14:19 CST)
- Re: Re: How can I measure bond length with “name ** and resid **" in scripts? (Tue Dec 19 2017 - 06:20:48 CST)
- Re: How can I measure bond length with “name ** and resid **" in scripts? (Tue Dec 19 2017 - 02:42:41 CST)
- Re: I would like to get a trajectory file in PDB. Can I use like data frame in VMD? (Wed Dec 13 2017 - 02:40:25 CST)
- Re: I would like to get a trajectory file in PDB. Can I use like data frame in VMD? (Wed Dec 13 2017 - 02:37:16 CST)
- Re: Moving atoms so that origin is at fixed position with respect to the display (Thu Oct 26 2017 - 14:41:59 CDT)
- Re: Finding atoms in protein-lipid system having electrostatic interaction (Wed Aug 09 2017 - 14:27:48 CDT)
- Re: solvate fails to set coordinates for the first few residues of the first chain? (Wed Apr 20 2016 - 00:29:41 CDT)
- Re: solvate fails to set coordinates for the first few residues of the first chain? (Tue Apr 19 2016 - 19:38:54 CDT)
- Re: solvate fails to set coordinates for the first few residues of the first chain? (Tue Apr 19 2016 - 19:33:32 CDT)
- Re: solvate fails to set coordinates for the first few residues of the first chain? (Tue Apr 19 2016 - 16:17:17 CDT)
- Re: Re: VMD Tricky selection of protein water bridge (2 bridge waters) (Fri Oct 02 2015 - 18:17:31 CDT)
- Re: How to extract data from NAMD log file for viscosity calculation (Tue Aug 18 2015 - 22:44:28 CDT)
- Re: How to continue the calculation of NAMD in case of power failure? (Sun May 17 2015 - 21:13:43 CDT)
- Re: Problem with generating psf and pdb files of metalloprotein made up of two fragments (Fri Mar 27 2015 - 06:11:27 CDT)
- Re: format I should use if I have different total number of atoms for each timesteps (Thu Dec 11 2014 - 20:58:14 CST)
- Re: A query about the deletion of Hydrogen and re-adding them by psfgen (Tue Dec 09 2014 - 19:44:20 CST)
- Re: A query about the deletion of Hydrogen and re-adding them by psfgen (Tue Dec 09 2014 - 16:50:08 CST)
- Fwd: How can I get the path of the TOP molecule in the tcl console? (Thu Dec 04 2014 - 22:15:51 CST)
- Re: Problem with merging structures!( psfgen) Warning: failed to set coordinate for atom AU0 AU:1 A) (Thu Nov 27 2014 - 08:48:56 CST)
- Re: Problem with merging structures!( psfgen) Warning: failed to set coordinate for atom AU0 AU:1 A) (Wed Nov 26 2014 - 17:02:34 CST)
- Ashish .Chauniyal
- ASHISH BIHANI
- Ashley Bennett
- Ashlynne Monroe
- Ashma Khan
- Ashraya Ravikumar
- asimplefunguy_at_netscape.net
- Asis Jana
- Asmaa Elsheshiny
- Assa Sittner
- Ata Madanchi
- Atanu Acharya
- Atanu Maity
- Athanassios Stavrakoudis
- Atila Iamarino
- Atila Petrosian
- rlwrap: Command not found. /usr/local/lib/vmd/vmd_LINUX: Command not found. (Fri Dec 09 2016 - 13:29:11 CST)
- Re: rlwrap: Command not found. /usr/local/lib/vmd/vmd_LINUX: Command not found. (Fri Dec 09 2016 - 01:55:18 CST)
- rlwrap: Command not found. /usr/local/lib/vmd/vmd_LINUX: Command not found. (Fri Dec 09 2016 - 01:49:42 CST)
- Atreya Dey
- Atreyo Pal
- Audrey Salazar
- Aurelie.DeLuca_at_sanofi-aventis.com
- Aurore Zyto
- Aurum Bai
- Austin Small
- AustinSmall_at_comcast.net
- Avell Diroll
- Avisek Das
- avl211_at_lehigh.edu
- Axel Berg
- Axel Kohlmeyer
- Re: Please help me understand the .dx file generated when using PME Electrostatics Analysis (Sat Dec 09 2023 - 14:48:21 CST)
- Re: Two questions: reordering molecule IDs and deleting frames with TCL commands (Sat Mar 11 2023 - 23:49:00 CST)
- Re: Two questions: reordering molecule IDs and deleting frames with TCL commands (Sat Mar 11 2023 - 23:23:27 CST)
- Re: Fwd: Problem building vmd with ospray - OSPRayRenderer.h error: ‘OSPModel’ does not name a typ (Thu Feb 23 2023 - 23:55:57 CST)
- Re: Problem with make_trajectory_movie_files script for lammps trajectory with -dispdev text (Fri Feb 17 2023 - 06:45:21 CST)
- Re: compiling VMD 1.9.3 under Ubuntu 22.04LTS: modern C library issues (Sat Jul 30 2022 - 16:04:14 CDT)
- Re: “Filesize limit exceeded (core dumped)Q=80=9D_with_VMD_on_Linux?= (Thu May 26 2022 - 12:09:10 CDT)
- Re: How to write a netcdf file in vmd from already loaded netcdf/dcd trajectory (Thu Dec 23 2021 - 06:16:31 CST)
- Re: Discrepancy in value of dihedral angles of a sugar molecule by VMD tools (Thu Jul 22 2021 - 07:41:39 CDT)
- Re: Compilation error: stride_LINUXAMD64', surf_LINUXAMD64, tachyon_LINUXAMD64 : No such file or directory (Thu Apr 22 2021 - 15:34:04 CDT)
- Re: BFEE plugin error: 'measure center: bad weight sum would cause divide by zero' (Thu Apr 22 2021 - 12:59:51 CDT)
- Re: Why do the coordinates of my atoms change when writing to a pdb file? (Sun Mar 21 2021 - 00:18:28 CDT)
- Re: OpenGL window not rendering over ssh but works when connecting from other computers and works fine locally (Thu Jan 21 2021 - 07:15:46 CST)
- Re: how to keep the bond , angle , dihedral and improper type after solvating the lammps data (Fri Jun 12 2020 - 15:04:44 CDT)
- Re: Is it possible to use VMD to plot RDFs where the cell volume/parameter changes at each time step? (Wed Oct 23 2019 - 15:49:48 CDT)
- Re: How to fix the position of the lipid bilayer in the trajectories (Wed Mar 13 2019 - 16:18:12 CDT)
- Re: Dipole Watcher Plugin - atom selection not updated at every frame when drawing dipoles (Mon Oct 22 2018 - 10:15:14 CDT)
- Re: Dipole Watcher Plugin - atom selection not updated at every frame when drawing dipoles (Thu Oct 18 2018 - 08:05:04 CDT)
- Re: Atomselection with the position selected conditions inside the loop is not working properly (Thu Aug 16 2018 - 08:14:03 CDT)
- Re: Building plugins with _USE_ZLIB (how to activate preprocessor macro) (Tue Mar 13 2018 - 16:53:08 CDT)
- Re: Building plugins with _USE_ZLIB (how to activate preprocessor macro) (Tue Mar 13 2018 - 16:32:37 CDT)
- Re: Building plugins with _USE_ZLIB (how to activate preprocessor macro) (Tue Mar 13 2018 - 16:30:12 CDT)
- Re: Atom type information is not incremented after merging two molecules. (Fri Feb 23 2018 - 04:02:27 CST)
- Re: Can specden produce the autocorrelation and not only the powerspectrum? (Tue Feb 06 2018 - 12:46:27 CST)
- Re: Topotools guessing angle and bond topology from CONNECT info in PDB files (Wed Nov 22 2017 - 13:25:20 CST)
- Re: Topotools guessing angle and bond topology from CONNECT info in PDB files (Wed Nov 22 2017 - 00:41:16 CST)
- Re: rlwrap: Command not found. /usr/local/lib/vmd/vmd_LINUX: Command not found. (Fri Dec 09 2016 - 13:51:56 CST)
- Re: rlwrap: Command not found. /usr/local/lib/vmd/vmd_LINUX: Command not found. (Fri Dec 09 2016 - 13:50:14 CST)
- Re: Distribute evenly n-molecules at m-angstroem from protein surface (Sun Dec 04 2016 - 00:29:54 CST)
- Re: selection atoms depending on bonding, selection of 'new' molecules (Fri Oct 14 2016 - 09:52:54 CDT)
- Re: by using Axel's HOOMD plugin, convert pdb to xml and missing bond information (Mon Sep 26 2016 - 06:11:58 CDT)
- Re: by using Axel's HOOMD plugin, convert pdb to xml and missing bond information (Sun Sep 25 2016 - 23:20:00 CDT)
- LAMMPS tutorial and Materials Simulation Symposium @ Temple, August 15-19, 2016 (Fri Apr 29 2016 - 21:11:16 CDT)
- Re: Problem wit solvating carbon nano-tube, psfgen) error reading atoms from psf file (Sun Feb 28 2016 - 11:48:58 CST)
- Re: What is the correct way of using "pbcwrap" with "atomselect [within]"? (Tue Feb 02 2016 - 02:07:21 CST)
- Re: OpenDX file format website down: What do the three values at each grid point represent (Mon Oct 05 2015 - 10:57:17 CDT)
- Re: OpenDX file format website down: What do the three values at each grid point represent (Fri Oct 02 2015 - 13:09:36 CDT)
- Re: Viewing gromacs .xtc trajectory 'Error reading timestep, file does not match format' (Thu Jun 25 2015 - 10:45:51 CDT)
- Re: Viewing gromacs .xtc trajectory 'Error reading timestep, file does not match format' (Thu Jun 25 2015 - 10:29:11 CDT)
- Re: Viewing gromacs .xtc trajectory 'Error reading timestep, file does not match format' (Thu Jun 25 2015 - 08:56:29 CDT)
- Re: Density Profile Tool: Is the selection updated as the frame is changed? (Wed May 27 2015 - 22:37:02 CDT)
- School on Molecular Dynamics and Enhanced Sampling Methods @ Temple University July 6-10, 2015 (Fri May 08 2015 - 11:29:01 CDT)
- Re: Fw: Colour coordinating atoms in a trajectory by Coordination Number (Mon Mar 30 2015 - 10:59:18 CDT)
- Re: Colour coordinating atoms in a trajectory by Coordination Number (Thu Mar 26 2015 - 12:08:48 CDT)
- GPU Programming workshop @ ICTP: deadline extended for participants not requiring visa and financial support (Tue Mar 24 2015 - 14:17:22 CDT)
- Re: Can I load NetCDF trajectories from AMBER in VMD on a Windows machine? (Sat Jan 17 2015 - 17:11:07 CST)
- Re: FFTK most probably doesn't work with molecules containing new atom types (Sat Dec 13 2014 - 18:15:42 CST)
- Re: FFTK most probably doesn't work with molecules containing new atom types (Sat Dec 13 2014 - 15:15:52 CST)
- Re: Problem with merging structures!( psfgen) Warning: failed to set coordinate for atom AU0 AU:1 A) (Thu Nov 27 2014 - 08:19:22 CST)
- Re: Problem with merging structures!( psfgen) Warning: failed to set coordinate for atom AU0 AU:1 A) (Wed Nov 26 2014 - 15:50:09 CST)
- Re: Problem with merging structures!( psfgen) Warning: failed to set coordinate for atom AU0 AU:1 A) (Wed Nov 26 2014 - 12:33:15 CST)
- Re: Problem with merging structures!( psfgen) Warning: failed to set coordinate for atom AU0 AU:1 A) (Wed Nov 26 2014 - 11:25:44 CST)
- Re: Problem with merging structures!( psfgen) Warning: failed to set coordinate for atom AU0 AU:1 A) (Wed Nov 26 2014 - 10:13:20 CST)
- Re: Fwd: namd-l: Why RDF increases as r increase instead of constant (Tue Nov 04 2014 - 14:29:41 CST)
- Re: Fwd: namd-l: Why RDF increases as r increase instead of constant (Tue Nov 04 2014 - 11:39:49 CST)
- Re: Fwd: namd-l: Why RDF increases as r increase instead of constant (Mon Nov 03 2014 - 15:49:48 CST)
- Re: Fwd: namd-l: Why RDF increases as r increase instead of constant (Mon Nov 03 2014 - 00:58:07 CST)
- Re: topotools question regarding ordering of bonds, angles, etc in output. (Fri Oct 03 2014 - 14:32:48 CDT)
- Re: topotools question regarding ordering of bonds, angles, etc in output. (Fri Oct 03 2014 - 13:16:37 CDT)
- Re: topotools question regarding ordering of bonds, angles, etc in output. (Fri Oct 03 2014 - 12:44:53 CDT)
- Re: create bonds with uniform pairwise cut off radius for XYZ trajectories. (Fri Sep 26 2014 - 06:47:40 CDT)
- Re: create bonds with uniform pairwise cut off radius for XYZ trajectories. (Fri Sep 26 2014 - 06:46:27 CDT)
- Re: create bonds with uniform pairwise cut off radius for XYZ trajectories. (Fri Sep 26 2014 - 03:59:32 CDT)
- Re: How to get all bond angles and bond distances for all atoms in sheet (Wed Sep 03 2014 - 10:30:27 CDT)
- Re: How to get all bond angles and bond distances for all atoms in sheet (Wed Sep 03 2014 - 10:17:38 CDT)
- Re: How to get all bond angles and bond distances for all atoms in sheet (Wed Sep 03 2014 - 03:07:04 CDT)
- Re: How to get all bond angles and bond distances for all atoms in sheet (Tue Sep 02 2014 - 08:37:31 CDT)
- Re: How to get all bond angles and bond distances for all atoms in sheet (Tue Sep 02 2014 - 08:42:38 CDT)
- Re: How to get all bond angles and bond distances for all atoms in sheet (Mon Sep 01 2014 - 08:19:05 CDT)
- Re: loading multiple trajectories with stride command in the terminal (Fri Jul 25 2014 - 10:42:57 CDT)
- School on Molecular Dynamics with NAMD and LAMMPS in Philadelphia, August 18-22 2014 (Thu Jul 17 2014 - 14:48:17 CDT)
- Re: convert AMBER format file to CHARMM format file or NAMD format file (Thu Apr 17 2014 - 11:03:49 CDT)
- Re: convert AMBER format file to CHARMM format file or NAMD format file (Wed Apr 16 2014 - 14:55:58 CDT)
- Re: Feature request: capturing tool location and steering forces in IMD trajectory (Mon Apr 07 2014 - 01:23:09 CDT)
- Re: problem for VMD extension_radial pair distribution function_truncation (Fri Mar 21 2014 - 11:08:28 CDT)
- Re: Why are all carbon atoms lumped into C in the Name category in the colors dialog? (Fri Nov 29 2013 - 19:13:50 CST)
- Re: Force field tool kit - missing close brackets-vmd version 1.9.2 (Mon Sep 30 2013 - 02:47:21 CDT)
- Re: Question regarding color schemes on crystals and grain boundaries (Sat Aug 31 2013 - 06:37:12 CDT)
- Re: Re: VRPN driver for Novint Falcon haptic device available - Looking for Testers (Sat Aug 17 2013 - 09:05:43 CDT)
- new VMD plugin for reading LAMMPS dumps with variable number of atoms (Thu Jul 25 2013 - 07:43:34 CDT)
- Re: Re: VRPN driver for Novint Falcon haptic device available - Looking for Testers (Wed Jul 03 2013 - 23:44:18 CDT)
- Re: how to calculate binding free energy and contribution of individual residue? (Mon Apr 22 2013 - 03:35:20 CDT)
- Re: put the water box in a grid and traverse for the atoms in each grid (Thu Apr 11 2013 - 03:20:26 CDT)
- Re: is there a way to measure the long axis of a protein or angle between domains in VMD (Wed Apr 10 2013 - 03:35:46 CDT)
- Re: Tethering, or restraining, part of a molecule during MD playback (Mon Mar 25 2013 - 01:42:46 CDT)
- Re: cp: cannot stat `../LINUXAMD64/vmd_LINUXAMD64': No such file or directory (Mon Mar 18 2013 - 11:00:26 CDT)
- Re: visualizing multiframe trajectory simultaneously with multimolecule (Mon Dec 17 2012 - 10:37:43 CST)
- Re: visualizing multiframe trajectory simultaneously with multimolecule (Sat Dec 15 2012 - 01:07:21 CST)
- Re: visualizing multiframe trajectory simultaneously with multimolecule (Thu Dec 13 2012 - 12:53:11 CST)
- Re: VMD 1.9.1 core dumps (CentOS-5 x86_64) nvidia drivers: 304.64/4x GTX 680 (Mon Dec 10 2012 - 10:22:49 CST)
- Re: Re: control the spacing between the dashes in the hydrogen bonding between two atoms (Tue Oct 30 2012 - 08:59:22 CDT)
- Re: Visualizing phonon displacement patterns from axsf format forces? (Sun Oct 21 2012 - 02:49:55 CDT)
- Re: coloring atoms based on max bond length; Need help with bond retrieval (Tue Oct 16 2012 - 10:33:57 CDT)
- Re: coloring atoms based on max bond length; Need help with bond retrieval (Mon Oct 15 2012 - 14:12:33 CDT)
- Re: VRPN driver for Novint Falcon haptic device available - Looking for Testers (Sun Oct 14 2012 - 13:31:12 CDT)
- Re: Possible handle leak in 'measure gofr' VMD 1.9.1 Windows (no cuda) (Sun Aug 26 2012 - 10:44:48 CDT)
- Re: Possible handle leak in 'measure gofr' VMD 1.9.1 Windows (no cuda) (Sun Aug 26 2012 - 08:05:00 CDT)
- Re: Scripting API: are arguments to representation types documented somewhere? (Mon Aug 20 2012 - 07:15:52 CDT)
- Re: connect a spring between all the atoms present in pdb structure (Sat Aug 04 2012 - 13:20:05 CDT)
- Re: namd-l: connect a spring between all the atoms present in pdb structure (Sat Aug 04 2012 - 13:21:27 CDT)
- anybody interested in running VMD in parallel (without recompiling)? (Wed May 30 2012 - 19:40:45 CDT)
- Re: Using Dipole Moment Watcher with Gromacs configurations and trajectories (Sat May 26 2012 - 16:19:26 CDT)
- Re: Making only a subset of atoms transparent (or otherwise non-emphasized) (Tue May 15 2012 - 13:38:17 CDT)
- Re: Is it possible to save the position and angle of the camera for future VMD sessions? (Fri Apr 13 2012 - 18:57:22 CDT)
- Re: Is there any way to stop the display of bonds for bonded atoms on opposite sides of a periodic boundary without unwrapping? (Fri Mar 30 2012 - 08:13:09 CDT)
- Re: information regarding tcl script for cell volume changing with each frame (Sat Mar 03 2012 - 17:25:43 CST)
- Re: information regarding tcl script for cell volume changing with each frame (Sat Mar 03 2012 - 14:45:14 CST)
- Re: How to change the python include and linkage path in configure script (Mon Feb 27 2012 - 13:33:18 CST)
- Re: [request] Best practices for rendering frames and making movies (Tue Feb 21 2012 - 18:29:19 CST)
- Re: Create multiple tcl interpreter child instances within VMD to run several scripts at once (Thu Feb 16 2012 - 12:46:48 CST)
- Re: Re: CUDA driver for Mac OS X 10.7 on Late 2008 13 inch Macbook with NVIDA GeForce 9400M 256 MB ? (Thu Jan 19 2012 - 13:55:04 CST)
- Re: Viewing System of Molecules where coordinates are in text file. (Thu Dec 01 2011 - 22:28:12 CST)
- Re: VMD never finishes reading vis. state file, stalls and hoggs CPU (Mon Nov 28 2011 - 10:21:20 CST)
- Re: VMD never finishes reading vis. state file, stalls and hoggs CPU (Fri Nov 25 2011 - 09:38:01 CST)
- Re: Use of RBCG to convert multiple frames from atomistic trajectory to Coarse grained (Tue Nov 01 2011 - 17:09:50 CDT)
- Re: coloring bonds on the same segments differently from those between segments (Thu Oct 20 2011 - 20:10:23 CDT)
- Re: How to select whole residues when at least one atom is within a specific distance (Thu Oct 13 2011 - 14:37:24 CDT)
- Re: Re: Selecting a laptop for VMD and NAMD (was: CUDA cores seen by VMD on GT540M) (Tue Sep 27 2011 - 10:36:20 CDT)
- Re: Showing and Calculating the amount of water molecules inside carbon nanotube (Tue Sep 13 2011 - 23:54:39 CDT)
- Re: define water cavity using atom selection in graphical representations window (Tue Sep 06 2011 - 09:28:45 CDT)
- Re: define water cavity using atom selection in graphical representations window (Tue Sep 06 2011 - 05:11:00 CDT)
- Re: define water cavity using atom selection in graphical representations window (Tue Sep 06 2011 - 05:31:23 CDT)
- Re: How can I draw secondary structures if I only have the carbon alpha coordinates (Thu Aug 18 2011 - 13:27:42 CDT)
- Re: how to draw different set of points for different frames in a trajectory my script does not work (Tue Jul 12 2011 - 15:17:50 CDT)
- Re: how to draw different set of points for different frames in a trajectory my script does not work (Fri Jul 08 2011 - 11:20:11 CDT)
- Re: how to draw different set of points for different frames in a trajectory my script does not work (Fri Jul 08 2011 - 08:31:17 CDT)
- Re: Re: best fit lines through two selections per each molecule ( I have 80 molecules) and the angle with another vector for each molecule (Tue Jun 28 2011 - 09:55:40 CDT)
- Re: trying to combine closewater.tcl with bigdcd.tcl error frame 3 out of range for molecule 0 (Wed May 25 2011 - 05:35:42 CDT)
- Re: trying to combine closewater.tcl with bigdcd.tcl error frame 3 out of range for molecule 0 (Tue May 24 2011 - 14:08:26 CDT)
- Re: trying to combine closewater.tcl with bigdcd.tcl error frame 3 out of range for molecule 0 (Tue May 24 2011 - 12:14:39 CDT)
- Re: vmd calculating wrong number of frames in xtc file using molinfo numframes ? (Mon May 23 2011 - 11:11:52 CDT)
- Re: Do psf generated by psfgen and psf produced by "$sel writepsf" function in VMD have different impact on MD simulation using NAMD? (Tue May 17 2011 - 09:44:26 CDT)
- Re: PhD position in Computational Structural Biology at MPI Muenster (Sun May 15 2011 - 16:47:40 CDT)
- Re: PhD position in Computational Structural Biology at MPI Muenster (Sun May 15 2011 - 11:51:22 CDT)
- Re: Questions about trajectory files obtained from LAMMPS Molecular dynamics with Reax Force field (Fri Apr 29 2011 - 08:36:01 CDT)
- Re: Linkage problem when compiling fortran bindings for VMD molfile plugins (Fri Mar 18 2011 - 11:14:31 CDT)
- Re: Linkage problem when compiling fortran bindings for VMD molfile plugins (Mon Mar 14 2011 - 18:08:53 CDT)
- Re: Linkage problem when compiling fortran bindings for VMD molfile plugins (Mon Mar 14 2011 - 13:43:28 CDT)
- Re: Dynamically updating water colors for each frame of a trajectory (Wed Feb 16 2011 - 18:01:35 CST)
- Re: VTF trajectory from coarse grained ESPReSo simulations. Visualization in Windows. (Wed Jan 12 2011 - 11:40:12 CST)
- Re: Volmap Tool: Angular or spatial correlation function around a center molecule (Thu Dec 30 2010 - 14:53:56 CST)
- Re: conversion of gromacs trajectory file (xtc) to amber trajectory file (mdcrd) (Sat Dec 25 2010 - 11:20:06 CST)
- Re: RE : Plot the value of the current frame in the Progress Bar for elapsed Time (Thu Dec 02 2010 - 13:44:37 CST)
- Re: Plot the value of the current frame in the Progress Bar for elapsed Time (Thu Dec 02 2010 - 10:47:31 CST)
- Re: protein breaks into parts after converting trajectory file to pdb file (Mon Sep 27 2010 - 10:32:58 CDT)
- Re: VMD questions about animating residue distance lines and contact maps (Fri Aug 13 2010 - 11:12:55 CDT)
- Re: Superimpose protein - plot water position - visualize water pathway (Sat Aug 07 2010 - 20:42:05 CDT)
- Re: PC suitable for visualisation of large systems, maximum namuber of atoms in a .pdb file (Wed Jul 21 2010 - 09:09:19 CDT)
- Re: PC suitable for visualisation of large systems, maximum namuber of atoms in a .pdb file (Wed Jul 21 2010 - 08:11:34 CDT)
- VRPN driver for Novint Falcon haptic device available - Looking for Testers (Fri Apr 23 2010 - 15:59:34 CDT)
- Re: vmd does not read pqr file correct, vmd parse chain information incorrect. (Tue Apr 20 2010 - 19:18:09 CDT)
- Re: problem with ied and vmd,ImportError: liblapack.so.3: cannot open shared object file: No such file or directory (Thu Mar 25 2010 - 10:49:09 CDT)
- Re: problem with ied and vmd,ImportError: liblapack.so.3: cannot open shared object file: No such file or directory (Thu Mar 25 2010 - 06:01:48 CDT)
- Re: bad text display in tk console (ubuntu 8.04 VMD 1.8.7 linux 32 bit) (Wed Jan 20 2010 - 11:42:57 CST)
- Re: bad text display in tk console (ubuntu 8.04 VMD 1.8.7 linux 32 bit) (Fri Jan 15 2010 - 12:11:21 CST)
- Re: aquire coordinates from the points of the solvent representation (Fri Nov 20 2009 - 13:23:11 CST)
- plugin for reading (and writing) trajectories with a varying number of atoms (Fri Nov 06 2009 - 14:51:02 CST)
- Re: namd-l: abnormal water surface after nvt and npt for POPC membrane (Wed Oct 28 2009 - 10:55:16 CDT)
- Re: Translating an atom along a specific direction and saving the pdb files (Tue Oct 20 2009 - 10:38:17 CDT)
- Re: X server is not capable of displaying double RGB images with a Z buffer (Tue Oct 20 2009 - 10:40:59 CDT)
- Re: Question about running tcl/tk script without graphic interface (vmd option -dispdev none ...) (Fri Oct 16 2009 - 18:25:07 CDT)
- Re: Why the win_version of vmd1.86 can not change to python interpreter? (Sat Aug 01 2009 - 09:30:12 CDT)
- Re: Problem: volumetric data coloring fails on AIX5_64 with GXT6500 OpenGL renderer (Thu Jul 23 2009 - 12:29:49 CDT)
- Re: Problem: volumetric data coloring fails on AIX5_64 with GXT6500 OpenGL renderer (Thu Jul 23 2009 - 11:23:34 CDT)
- Re: Problem: volumetric data coloring fails on AIX5_64 with GXT6500 OpenGL renderer (Mon Jul 20 2009 - 15:43:56 CDT)
- Re: Problem: volumetric data coloring fails on AIX5_64 with GXT6500 OpenGL renderer (Mon Jul 20 2009 - 11:36:28 CDT)
- Re: How to make a selection in atomselect using an element in a list? (Wed Jul 08 2009 - 11:17:14 CDT)
- GPGPU Programming summer school at University of Tennessee, Aug 10-14. (Mon Jun 29 2009 - 14:44:15 CDT)
- Re: "Re: ABINIT plugin ready for testing: can read GEO and DEN files. (Thu Jun 18 2009 - 11:13:59 CDT)
- Re: Re: ABINIT plugin ready for testing: can read GEO and DEN files. (Wed Jun 17 2009 - 12:01:30 CDT)
- Re: Re: ABINIT plugin ready for testing: can read GEO and DEN files. (Tue Jun 16 2009 - 22:59:20 CDT)
- Re: Re: ABINIT plugin ready for testing: can read GEO and DEN files. (Tue Jun 16 2009 - 07:31:03 CDT)
- Re: FW: Unable to render electrostatic potential cube files with most non-HF densities (Thu Jun 11 2009 - 09:19:21 CDT)
- bigdcd are related issues. was: Re: VMD 1.8.7 beta 3 posted for download... (Mon May 25 2009 - 11:42:59 CDT)
- Re: Plugin: molfile_plugin_t filename_extension; problem and bug... (Mon May 25 2009 - 09:52:04 CDT)
- Re: Sphere representaion with radius from pdb field "occupancy" or "temp. fac" (Wed May 13 2009 - 05:56:32 CDT)
- Re: Can the CG model built from VMD be used as an Input of NAMD,GROMACS and any other MD program? (Tue Apr 28 2009 - 08:32:24 CDT)
- Re: local packing density around a chemical group (say, a methyl group or a side chain) (Thu Apr 23 2009 - 11:27:20 CDT)
- Re: Can you show me an example of the .xyz file that is used to calculate the IR spectrum (Mon Feb 23 2009 - 14:46:18 CST)
- Re: passing arguments to a vmd script which is executed using play or source (Mon Feb 23 2009 - 10:20:55 CST)
- Re: passing arguments to a vmd script which is executed using play or source (Mon Feb 23 2009 - 09:15:44 CST)
- Re: passing arguments to a vmd script which is executed using play or source (Mon Feb 23 2009 - 09:08:58 CST)
- Re: error messages "*** glibc detected *** free(): invalid pointer" (Mon Feb 16 2009 - 12:26:19 CST)
- Re: how to set color parameters differently for different molecules (Thu Jan 29 2009 - 20:35:35 CST)
- Re: how to set color parameters differently for different molecules (Sun Jan 25 2009 - 13:18:10 CST)
- Re: accessing bonds angles dihedrals etc lists after PSF file is read into VMD (Fri Jan 23 2009 - 16:20:30 CST)
- Re: the exact definition of the keyword "radius" of the atom selection (Sat Dec 13 2008 - 16:37:11 CST)
- Re: [Fwd: problems with manipulating control switches on VMS main menu] (Fri Oct 31 2008 - 18:05:46 CDT)
- Re: why atomselection "protein" can not choose all the protein atoms with different alternate locations? (Mon Oct 13 2008 - 18:23:35 CDT)
- Re: trouble with running vmd after installation , machine gets hung (Sun Sep 21 2008 - 03:13:41 CDT)
- Re: trouble with running vmd after installation , machine gets hung (Fri Sep 19 2008 - 06:05:42 CDT)
- Re: problem controlling orientation of the simulation box drawn by pbctools (Sun Aug 10 2008 - 11:11:34 CDT)
- Re: Selecting atoms that have real SASA greater than 0, Not using "Surface" (Tue Jul 29 2008 - 20:40:30 CDT)
- Re: Mac OSX crash with bus error/segmentation fault upon loading pdb/dcd (Mon Jun 30 2008 - 13:17:20 CDT)
- Re: opening gromacs .gro file gives warning messsage and does not display the molecule (Tue Jun 17 2008 - 09:11:03 CDT)
- Re: measure hbonds between protein and water - problem with periodic boundary conditions (Thu Apr 17 2008 - 04:52:29 CDT)
- Re: compilation with python 2.5 and file permissions from the CVS repository (Mon Apr 14 2008 - 05:16:19 CDT)
- RE: compilation with python 2.5 and file permissions from the CVS repository (Sun Apr 13 2008 - 15:00:12 CDT)
- Re: compilation with python 2.5 and file permissions from the CVS repository (Sun Apr 13 2008 - 12:58:26 CDT)
- Re: Can VMD show the interactions between different structure part? (Thu Mar 27 2008 - 06:43:41 CDT)
- Re: Can VMD show the interactions between different structure part? (Wed Mar 26 2008 - 23:19:40 CDT)
- Re: unusual bond between the cysteine and arginine residue during the simulation (Fri Feb 29 2008 - 13:47:55 CST)
- Re: how to load a molecule in pdb format and save in mol2 format in batch mode (Mon Jan 14 2008 - 03:39:58 CST)
- Re: How to choose part of the volume data for isosurface visualization? (Tue Jan 08 2008 - 11:37:29 CST)
- Re: Selecting water molecules within 5 ang in a trajectory( generated by amber). (Wed Dec 26 2007 - 14:12:05 CST)
- Re: Trying to get VMD to run locally while logged into a remote machine (Wed Nov 21 2007 - 16:35:50 CST)
- Re: gui RMSD vs text RMSD calcs differ b/c ddiff backbone atom definitions (Sat Nov 17 2007 - 00:11:54 CST)
- Re: installed vmd_LINUXIA64 but recieve error : /usr/local/vmd/vmd_LINUX: command not found (Wed Nov 14 2007 - 20:34:06 CST)
- Re: installed vmd_LINUXIA64 but recieve error : /usr/local/vmd/vmd_LINUX: command not found (Tue Nov 13 2007 - 23:50:04 CST)
- Re: problem with colouring the surface with electroststic potential (Tue Nov 13 2007 - 02:15:54 CST)
- behavior of "mol addfile first/last" with non-integer frame numbers (Thu Sep 27 2007 - 19:35:40 CDT)
- Re: change the representation of certain atoms which pass a geometric criterion during a movie (Tue Sep 18 2007 - 08:34:29 CDT)
- Re: the console window is automatically closed without any error messages (Thu Sep 06 2007 - 12:50:08 CDT)
- Re: Changing the Index values of a molecule (the differenece between gro and pdb files) (Wed Aug 15 2007 - 12:51:30 CDT)
- Re: Very peculiar problem with bigdcd if not running interactively (post moved over from namd forum) (Wed Aug 15 2007 - 10:47:46 CDT)
- Re: how to make user input during runtime of a tcl program using TkConsole? (Fri Aug 10 2007 - 10:20:47 CDT)
- Re: Loading files into already-running version of VMD from command prompt (Sat Aug 04 2007 - 16:04:31 CDT)
- Re: orientation of hexahedrons parallelepipeds unit cells relative to x,y axes (Sat Jul 28 2007 - 17:24:08 CDT)
- Re: frame number input in tcl and direct mol graph display update (II) (Fri Jul 27 2007 - 13:56:05 CDT)
- Re: nonstandard solvate + cyclic peptides in explicit DMSO box + gofr (Thu Jul 26 2007 - 11:48:08 CDT)
- Re: Using VMD just to plot some coordinates from a mathematical/geometrical model (Sat Jun 23 2007 - 09:23:20 CDT)
- Re: lipid Scd order parameter for a large bilayer (1440 lipids) with a changing bilayer normal (ie. bilayer undulations) (Wed May 30 2007 - 14:14:08 CDT)
- Re: problem using bigdcd.tcl script does not run beyond the first frame no error reported (Mon May 07 2007 - 08:36:50 CDT)
- Re: RE: "which files to make a spatial grid?" => Bug for list command? (Tue Apr 17 2007 - 07:25:11 CDT)
- Re: problem using NAMD trajectory in charmm 32-bit, 64-bit etc. (yes, I posted this on charmm lists too) (Tue Apr 03 2007 - 09:20:25 CDT)
- Re: VMD-1.8.5: GLSL & NVidia troubles + fixed previous Spaceball problem (Sun Feb 11 2007 - 12:51:06 CST)
- Re: Saving mutli-molecule structures in VMD (e.g., for building membranes) (Mon Feb 05 2007 - 12:09:15 CST)
- Re: Error while running scripts: terminate called after throwing an instance of 'std::bad_alloc' (Sat Feb 03 2007 - 06:31:49 CST)
- Re: Compute the angle between a vector and the largest inertia axis (Tue Jan 30 2007 - 11:16:32 CST)
- Re: VMD 1.8.5 installed. The graphics flashed and disappeared after installation. (Tue Dec 19 2006 - 14:15:00 CST)
- Re: imposing period boundary conditions in a simulation with a crystal (Wed Sep 06 2006 - 09:23:39 CDT)
- Re: imposing period boundary conditions in a simulation with a crystal (Tue Sep 05 2006 - 12:00:19 CDT)
- Re: VMD crashed due to: vmd_LINUXAMD64: indirect_vertex_array.c:659: emit_DrawArrays_old: Assertion `elements_per_request >= count' failed (Tue Jun 27 2006 - 22:17:01 CDT)
- Re: VMD crashed due to: vmd_LINUXAMD64: indirect_vertex_array.c:659: emit_DrawArrays_old: Assertion `elements_per_request >= count' failed (Tue Jun 27 2006 - 19:53:00 CDT)
- Re: How to select water near a certain residue if it is outside of the water box? (Sat May 13 2006 - 18:11:27 CDT)
- Re: VMD-L: how to select water molecules between two residues in a trajectory. (Mon Apr 17 2006 - 11:33:38 CDT)
- Re: VMD-L: how to select water molecules between two residues in a trajectory. (Mon Apr 17 2006 - 10:50:38 CDT)
- Re: VMD-L: how to select water molecules between two residues in a trajectory. (Sat Apr 15 2006 - 20:31:11 CDT)
- Re: using gimp for converting jpg, tga ... images to high quality eps files (Mon Feb 07 2005 - 06:31:44 CST)
- Re: using gimp for converting jpg, tga ... images to high quality eps files (Sat Feb 05 2005 - 04:58:35 CST)
- Re: Re: vmd not starting up on Fedora core 3 linux , nVidia quadro 980 XGL, nVidia 6629 driver (Tue Jan 11 2005 - 10:50:57 CST)
- Re: vmd not starting up on Fedora core 3 linux , nVidia quadro 980 XGL, nVidia 6629 driver (Fri Jan 07 2005 - 07:20:17 CST)
- Re: vmd not starting up on Fedora core 3 linux , nVidia quadro 980 XGL, nVidia 6629 driver (Fri Jan 07 2005 - 06:37:21 CST)
- Re: vmd not starting up on Fedora core 3 linux , nVidia quadro 980 XGL, nVidia 6629 driver (Fri Jan 07 2005 - 05:40:13 CST)
- AYTUG TUNCEL
- Ayşe Özlem Aykut
- Aye zlem Sezerman
- Aziz, John
- B
- B $B6Q
- B. Bennion
- B.D Allen
- B.M.B. Vanschouwen
- Babban Mia
- Bachir Aoun
- Badmos, Sakiru
- Bahaa Mostafa
- Bailey, Steven
- Bakary N'tji Diallo
- Baker, Joseph
- Bala subramanian
- balas002_at_bama.ua.edu
- Balazs Jojart
- BALCZIAK, LOUIS
- Balu, Radhakrishnan (Cont, ARL/WMRD)
- Bamidele Adisa
- Ban Arn
- BAN,YOUNG MIN
- Bankf of the West
- Baofu Qiao
- baogen duan
- Baoqiang Cao
- Barbault Florent
- barrett
- Barry Bickmore
- Barry Isralewitz
- Re: what's the Letter in figure caption meaning of TIME-LINE 2nd structure present? (Mon May 07 2012 - 12:32:42 CDT)
- Re: Visualizing Timeline (tml) data w/o having to load trajectories (Thu Oct 27 2011 - 13:25:08 CDT)
- Bart Bruininks
- Re: VRAM memory piling up OPTIX 1.9.4a42 rendering consecutive frames (Tue Jun 16 2020 - 07:29:14 CDT)
- Re: VRAM memory piling up OPTIX 1.9.4a42 rendering consecutive frames (Wed Jun 10 2020 - 11:07:58 CDT)
- Re: VRAM memory piling up OPTIX 1.9.4a42 rendering consecutive frames (Wed Jun 10 2020 - 08:37:09 CDT)
- Re: Loading large trajectories using multiple threads/direct calls? (Thu Dec 05 2019 - 17:06:26 CST)
- Bartek Dobrzelecki
- Basak Isin
- Basanta Acharya
- Basheer Subei
- Bashir
- Bashir Fotouhi
- Bassam Haddad
- Re: Create Binding Pocket of Every PDB File In A Directory Using TCL Scripts and Atomselect Command protein and within 4 of resname LIG (Mon Jul 20 2020 - 13:31:24 CDT)
- Re: Create Binding Pocket of Every PDB File In A Directory Using TCL Scripts and Atomselect Command protein and within 4 of resname LIG (Mon Jul 20 2020 - 12:58:36 CDT)
- Re: analyzing amino acids forming pore constrictions in a channel protein (Tue Jun 02 2020 - 12:33:03 CDT)
- Baumert, Uwe Dr.rer.nat.
- baxy
- bbickmore_at_comcast.net
- Beat Meier
- Behnam Ghalami
- Behrmann, Elmar
- Ben Chern
- Re: Can VMD show the interactions between different structure part? (Thu Mar 27 2008 - 20:26:13 CDT)
- Ben Cornett
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- Benjamin.Haberl_at_physik.uni-muenchen.de
- Bennion, Brian
- RE: how to explore the frame number in clustering analysis by the clustering plugin (Thu Jul 07 2016 - 16:05:37 CDT)
- RE: a script to count the frames in which some water molecules interact with selected protein atoms (Tue Dec 30 2014 - 10:25:41 CST)
- RE: how to convert dcd AND ALIGN molecules then to pdbs in command line (Thu Apr 11 2013 - 10:08:08 CDT)
- RE: how to convert dcd AND ALIGN molecules then to pdbs in command line (Wed Apr 10 2013 - 11:52:03 CDT)
- RE: visualizing multiframe trajectory simultaneously with multimolecule (Mon Dec 17 2012 - 10:19:02 CST)
- RE: visualizing multiframe trajectory simultaneously with multimolecule (Fri Dec 14 2012 - 17:06:03 CST)
- visualizing multiframe trajectory simultaneously with multimolecule (Thu Dec 13 2012 - 11:46:18 CST)
- RE: VMD can't display new PDB secondary structure properly (pyMol, jMol can) (Mon Nov 19 2012 - 17:30:19 CST)
- BERGY
- Berit Hinnemann
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- Re: Ignore all the errors and load severely wrong structure in XYZ format (Sat Jun 10 2017 - 16:07:40 CDT)
- Bharath K. Srikanth
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- Re: VMD never finishes reading vis. state file, stalls and hoggs CPU (Wed Nov 30 2011 - 10:11:53 CST)
- Re: VMD never finishes reading vis. state file, stalls and hoggs CPU (Mon Nov 28 2011 - 02:54:17 CST)
- Re: VMD never finishes reading vis. state file, stalls and hoggs CPU (Fri Nov 25 2011 - 05:36:26 CST)
- Bjoern Windshuegel
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- Re: Problems with licorice representation when rendering 3D PDF for Power Point (Fri Apr 23 2010 - 09:59:08 CDT)
- Problems with licorice representation when rendering 3D PDF for Power Point (Thu Apr 22 2010 - 14:56:52 CDT)
- Bob Milius
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- Re: Slow display with nVidia GeForce 9400GT and 3xx drivers on Linux (Mon Apr 15 2013 - 05:51:10 CDT)
- Re: Slow display with nVidia GeForce 9400GT and 3xx drivers on Linux (Mon Mar 18 2013 - 07:19:09 CDT)
- Re: Slow display with nVidia GeForce 9400GT and 3xx drivers on Linux (Fri Mar 08 2013 - 11:56:12 CST)
- Re: Re: VMD 1.9.1 core dumps (CentOS-5 x86_64) nvidia drivers: 304.64/4x GTX 680 (Tue Dec 11 2012 - 07:50:23 CST)
- Re: vmd not starting up on Fedora core 3 linux , nVidia quadro 980 XGL, nVidia 6629 driver (Tue Jan 11 2005 - 10:42:25 CST)
- Bogdan Tarus
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- Re: VMD can't display new PDB secondary structure properly ( pyMol, jMol can). . (Tue Nov 20 2012 - 14:44:53 CST)
- Borne, Vincent
- Bose, Ritwika
- Boshra Moradi
- bozell, joe
- brad noyes
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- Brandon Havranek
- Branko
- brataraj ghosh
- BRAULIO FAVIN VALDEBENITO MATURANA
- BRAULIO VALDEBENITO MATURANA
- Breght Boschker
- Brendan Dennis
- Re: Running VMD 1.9.4alpha on newer GPUs that require CUDA 11+ and OptiX 7+ (Wed Feb 01 2023 - 13:51:43 CST)
- Re: Running VMD 1.9.4alpha on newer GPUs that require CUDA 11+ and OptiX 7+ (Wed Feb 01 2023 - 01:10:25 CST)
- Re: Running VMD 1.9.4alpha on newer GPUs that require CUDA 11+ and OptiX 7+ (Tue Jan 31 2023 - 16:48:10 CST)
- Brendan O'Malley
- Bret Hess
- Brett Pemberton
- Re: VMD crashed due to: vmd_LINUXAMD64: indirect_vertex_array.c:659: emit_DrawArrays_old: Assertion `elements_per_request >= count' failed (Tue Jun 27 2006 - 22:37:59 CDT)
- Re: VMD crashed due to: vmd_LINUXAMD64: indirect_vertex_array.c:659: emit_DrawArrays_old: Assertion `elements_per_request >= count' failed (Tue Jun 27 2006 - 20:59:56 CDT)
- Brian Bennion
- Re: X_ChangeProperty: BadValue (integer parameter out of range for operation) 0x40 (Mon Jan 07 2008 - 10:58:36 CST)
- Brian Corrie
- Brian Dotson
- Brian Guthrie
- Brian Kidd
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- Brian Puchala
- Brian Radak
- Re: RTX-accelerated VMD 1.9.4 test build for 64-bit Linux posted... (Mon Mar 11 2019 - 16:57:12 CDT)
- Re: namd-l: Re: PSFGEN 1.6.4 autogenerate PATCH keyword not available (Tue Apr 24 2018 - 11:23:47 CDT)
- Re: namd-l: ParseFEP error with FEP in segments at different lambda schedule (Tue Apr 10 2018 - 07:56:40 CDT)
- Brian Smith
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- Bruce D'Amora
- Bruininks, B.M.H.
- Bruno Lus Pinto de Oliveira
- Bryan Roessler
- Re: Feature request: "Apply to all molecules" option in graphical representation window (Wed Jan 18 2017 - 17:44:29 CST)
- Feature request: "Apply to all molecules" option in graphical representation window (Wed Jan 18 2017 - 17:06:48 CST)
- Re: Ideal charge optimization strategy for atoms with existing ff parameters (Tue Oct 20 2015 - 15:34:48 CDT)
- Re: Ideal charge optimization strategy for atoms with existing ff parameters (Mon Oct 19 2015 - 09:45:32 CDT)
- Re: Ideal charge optimization strategy for atoms with existing ff parameters (Fri Oct 16 2015 - 10:01:53 CDT)
- Bryce Vang
- bsnmrem-obj_at_yahoo.com
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- bybaker_at_itsa.ucsf.edu
- Bylund, Tatsiana (NIH/NIAID) [F]
- C L Freeman
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- Re: How to choose solid color in clipping plane render with POV-Ray (Tue Aug 30 2022 - 12:42:58 CDT)
- ACS COMP Division travel awards for Spring 2015 National Meeting in Denver (Fri Sep 12 2014 - 09:42:32 CDT)
- Re: any way to rotate and translate with mouse without changing modes? (Wed Jun 25 2014 - 11:42:32 CDT)
- Re: any way to rotate and translate with mouse without changing modes? (Wed Jun 25 2014 - 09:30:48 CDT)
- carlos_at_avalon.umaryland.edu
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- Cecilia Lindgren
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- Calculating acyl chain order parameter profile on phospholipid vesicles (Thu Jan 08 2009 - 15:43:55 CST)
- Re: lipid Scd order parameter for a large bilayer (1440 lipids) with a changing bilayer normal (ie. bilayer undulations) (Wed Jun 06 2007 - 10:55:19 CDT)
- Re: lipid Scd order parameter for a large bilayer (1440 lipids) with a changing bilayer normal (ie. bilayer undulations) (Wed May 30 2007 - 20:36:09 CDT)
- Cesar Millan
- Cetin Baloglu
- cgji
- Ch. Fufezan
- Chaitanya Krishna
- Chaitanya Krishna A
- Chan, Matthew
- Chanda.Jnanojjal_at_edam.uhp-nancy.fr
- Chandra Ramananjara
- chandrakala gowda
- chandran karunakaran
- Chang Hu
- Chang, Christopher
- Re: cannot visualize GROMACS trajectories in VMD 1.9.4 on MacOS Big Sur (Tue Mar 16 2021 - 10:54:00 CDT)
- Re: Configuring Tkcon in VMD for Catalina to access history with up arrow (Fri Jul 24 2020 - 14:31:02 CDT)
- Configuring Tkcon in VMD for Catalina to access history with up arrow (Thu Jul 23 2020 - 17:16:32 CDT)
- RE: Loading multiple molecules in one step / "Apply changes automatically" (Fri Oct 21 2005 - 11:15:40 CDT)
- Changbong Hyeon
- chanyann06_at_stu.scu.edu.cn
- Chapman, John O.
- charbott_at_gmail.com
- Chari, Ravi
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- Re: Feature request: Change printf( to fprintf(stderr, in molfile plugins (Fri Jan 29 2016 - 11:13:40 CST)
- CHARLES MCCALLUM
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- Chen, Bo (NIH/NIDDK) [F]
- CHEN, Chi
- Chen, Zhihong (chenz2)
- Chenbo Yan
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- Cheng Luo, Ph.D.
- Cheng, Kelvin
- chenmengen
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- cheol_at_rccd.snu.ac.kr
- Cheri M Turman
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- Chia-Ju Hsieh
- Chiara Cardelli
- chiessi_at_uniroma2.it
- Re: Discrepancy in value of dihedral angles of a sugar molecule by VMD tools (Fri Jul 23 2021 - 04:42:54 CDT)
- chiloo777 777
- chin chun
- Chintapalli, Sree vamsee
- Chirag Vora
- CHIRANJEEV BURMA
- Chitrak Gupta
- Re: namd-l: Is there someway to render protein picture without background color? (Sat Sep 14 2019 - 20:52:08 CDT)
- Re: How to calculate head group and acyl chain contact (separately) within 5 Anstrom of a particular protein residue? (Wed Jan 10 2018 - 10:15:00 CST)
- Re: TCL script to track molecules moving within a specified region each time frame (Mon May 16 2016 - 13:53:54 CDT)
- Re: TCL script to track molecules moving within a specified region each time frame (Mon May 16 2016 - 11:30:33 CDT)
- Re: Unable to visualize my polymer chains generated using RIS theory using VMD properly (Tue Mar 29 2016 - 08:11:27 CDT)
- Re: Unable to visualize my polymer chains generated using RIS theory using VMD properly (Sun Mar 20 2016 - 17:27:42 CDT)
- Re: Ideal charge optimization strategy for atoms with existing ff parameters (Wed Oct 21 2015 - 10:45:08 CDT)
- Re: Ideal charge optimization strategy for atoms with existing ff parameters (Mon Oct 19 2015 - 10:59:52 CDT)
- ChoiHeeSung
- Chola Regmi
- Chowdhury, Sanjib Chandra
- Chris Berthiaume
- Chris Broomell
- Chris Harrison
- Chris Ing
- Chris Knorowski
- Chris Neale
- Chris Taylor
- Re: compile vmd-1.9.4a57 source - OptiXRenderer.h:84:10: fatal error: optix_math.h: No such file or directory (Fri Jul 26 2024 - 22:11:53 CDT)
- Re: compile vmd-1.9.4a57 source - OptiXRenderer.h:84:10: fatal error: optix_math.h: No such file or directory (Fri Jul 26 2024 - 22:15:58 CDT)
- compile vmd-1.9.4a57 source - OptiXRenderer.h:84:10: fatal error: optix_math.h: No such file or directory (Fri Jul 26 2024 - 00:22:45 CDT)
- Re: CUDA error: an illegal memory access was encountered, CUDAQuickSurf.cu (Mon Apr 17 2023 - 22:40:59 CDT)
- Re: CUDA error: an illegal memory access was encountered, CUDAQuickSurf.cu (Mon Apr 10 2023 - 20:08:42 CDT)
- CUDA error: an illegal memory access was encountered, CUDAQuickSurf.cu (Sun Apr 09 2023 - 22:07:14 CDT)
- INITIALIZATION ERROR --> OSPRay not yet initialized - WIN64, version 1.9.4a53 (Mon Sep 26 2022 - 18:31:01 CDT)
- Re: Parallel rendering example from tutorial, "VMD parallel commands" (Fri May 06 2022 - 20:07:16 CDT)
- Chris Upton
- chris.harwell_at_pharma.novartis.com
- chris.neale_at_utoronto.ca
- Christer Svanberg
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- Christian Leitold
- Re: Building plugins with _USE_ZLIB (how to activate preprocessor macro) (Tue Mar 13 2018 - 17:33:24 CDT)
- Re: Building plugins with _USE_ZLIB (how to activate preprocessor macro) (Tue Mar 13 2018 - 15:25:36 CDT)
- Christian Mcksch
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- Christopher Gillespie
- Re: Selecting atoms that have real SASA greater than 0, Not using "Surface" (Tue Jul 29 2008 - 18:39:14 CDT)
- Christopher Gutnajer
- Christopher Hartshorn
- Christopher MacDermaid
- Christopher McLean
- Christopher Neale
- Is occulus rift plug-and-play with VMD yet? If so, what are the capabilities? (Sat Aug 12 2017 - 11:29:49 CDT)
- Christopher Share
- Christopher Stiles
- Chuck
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- Claire Loison
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- CLEMENTS, ROBERT
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- cmorton_at_medstv.unimelb.edu.au
- CMP
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- cojocaru vlad
- Cojocaru, Vlad
- Cojocaru,Vlad
- RE: compilation with python 2.5 and file permissions from the CVS repository (Sun Apr 13 2008 - 14:50:44 CDT)
- compilation with python 2.5 and file permissions from the CVS repository (Sun Apr 13 2008 - 12:24:52 CDT)
- Collette Riviere
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- Cristina
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- Crosskey, Mark William
- Crowley, Michael
- Cruzeiro,Vinicius Wilian D
- Crystal Liu
- CSM USP
- csu1505110121_at_163.com
- cubellis_at_unina.it
- Cun Zhang
- Re: how to make the picture size suitable for the image size in pov file ? (Fri Dec 31 2010 - 20:08:42 CST)
- how to make the picture size suitable for the image size in pov file ? (Thu Dec 30 2010 - 20:52:14 CST)
- cyclone_at_team.planetsweep.com
- Cyril Bauvais
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- Re: How to visualize unusual amino acid in VMD with Cartoon or ribbon representation (Wed Jul 01 2020 - 17:55:56 CDT)
- Re: New VMD 1.9.4 test versions posted with many new updates/features... (Tue Jul 16 2019 - 17:18:16 CDT)
- Re: New VMD 1.9.4 test versions posted with many new updates/features... (Sun Jul 14 2019 - 20:10:43 CDT)
- Re: RTX-accelerated VMD 1.9.4 test build for 64-bit Linux posted... (Mon Apr 29 2019 - 19:00:35 CDT)
- Re: RTX-accelerated VMD 1.9.4 test build for 64-bit Linux posted... (Mon Apr 29 2019 - 18:59:40 CDT)
- Re: RTX-accelerated VMD 1.9.4 test build for 64-bit Linux posted... (Mon Apr 29 2019 - 18:52:15 CDT)
- Fwd: Protein backbone representation for non standard residues / molecules (Wed Mar 28 2018 - 22:21:46 CDT)
- Re: Fwd: Termination when using QuickSurf, libGL no version info, and CUDA Error in start up (Tue Mar 07 2017 - 19:36:13 CST)
- Re: Fwd: Termination when using QuickSurf, libGL no version info, and CUDA Error in start up (Tue Mar 07 2017 - 19:21:08 CST)
- Re: Fwd: Termination when using QuickSurf, libGL no version info, and CUDA Error in start up (Tue Mar 07 2017 - 19:31:27 CST)
- Re: Fwd: Termination when using QuickSurf, libGL no version info, and CUDA Error in start up (Mon Mar 06 2017 - 22:08:56 CST)
- Re: Fwd: Termination when using QuickSurf, libGL no version info, and CUDA Error in start up (Mon Mar 06 2017 - 21:09:54 CST)
- Re: Fwd: Termination when using QuickSurf, libGL no version info, and CUDA Error in start up (Mon Mar 06 2017 - 20:12:11 CST)
- Re: Fwd: Termination when using QuickSurf, libGL no version info, and CUDA Error in start up (Tue Feb 28 2017 - 19:08:46 CST)
- Fwd: Termination when using QuickSurf, libGL no version info, and CUDA Error in start up (Mon Feb 27 2017 - 18:32:54 CST)
- dalpizar_at_fbio.uh.cu
- Damian Loska
- Damiano Buratto
- Damien Serres
- Damien Touraine
- Dan Fishelovitch
- Dan Gordon
- Dan J Martingano
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- Dan Michael O. Heggø
- Dan Strahs
- Dan thomas Major
- Dan White
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- Dan Wright
- Dani
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- Daniel Adrion
- Daniel Aguayo
- Daniel Aiello
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- Daniel Barsky
- Daniel Beaman
- Re: Trying to get VMD to run locally while logged into a remote machine (Mon Nov 26 2007 - 20:09:30 CST)
- Re: Trying to get VMD to run locally while logged into a remote machine (Mon Nov 26 2007 - 19:30:32 CST)
- Daniel Brooks
- Daniel Farrell
- Daniel Fellner
- Daniel Gaston
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- Daniel Han
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- Daniel Mller
- AW: question about reading more volumes via atomselect or removing of them (Thu Jan 14 2016 - 05:37:52 CST)
- Daniel Russel
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- Daou, Joseph A
- Darre Castell, Leonardo
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- Darren Li
- Q=9B=9E=E5=A4=8D=EF=BC=9A__by_using_Ax?= el's HOOMD plugin, convert pdb to xml and missing bond information (Mon Sep 26 2016 - 09:08:56 CDT)
- Darui Xu
- Das, Debasish
- Dave Arias (NelsonDa)
- Dave Humbird
- Dave Pugmire
- Dave Schall
- Re: topotools question regarding ordering of bonds, angles, etc in output. (Fri Oct 03 2014 - 13:25:27 CDT)
- Re: topotools question regarding ordering of bonds, angles, etc in output. (Fri Oct 03 2014 - 12:51:22 CDT)
- David A. Horita
- David A. Case
- David Alejandro Rincón Daza
- David Brandon
- Workshop on Very Large System Simulation, Urbana, IL, August 11-15, 2014 (Sat May 17 2014 - 18:26:44 CDT)
- Workshop on GPU Programming for Molecular Modeling, in Urbana, Illinois, July 22-24, 2014 (Fri Apr 18 2014 - 16:42:16 CDT)
- "Hands-on" Workshop on Computational Biophysics at Lake Tahoe, August 4-8, 2014 (Tue Apr 01 2014 - 16:23:08 CDT)
- Computational Biophysics Workshop using NAMD and VMD, November 18-22, 2013, Urbana, Illinois, USA (Fri Aug 23 2013 - 14:15:11 CDT)
- Workshop on GPU Programming for Molecular Modeling, August 2-4, 2013, in Urbana, Illinois (Wed Jun 12 2013 - 11:03:08 CDT)
- 'Hands-on' Workshop on Computational Biophysics using VMD, NAMD, and ProDy, June 10-14, 2013 in Pittsburgh, PA (Fri Mar 08 2013 - 12:22:27 CST)
- 'Hands-On' Workshop on Computational Biophysics using VMD and NAMD, October 22-26, 2012 in Urbana, Illinois (Mon Jul 09 2012 - 14:32:25 CDT)
- 'Hands-On' Workshop on Computational Biophysics using VMD and NAMD, February 11-15, 2012 in Urbana, Illinois (Thu Nov 17 2011 - 13:53:59 CST)
- 'Hands-On' Workshop on Computational Biophysics using VMD and NAMD, October 17-21, 2011, Bremen, Germany (Fri Jul 29 2011 - 14:15:06 CDT)
- David Carrasco de Busturia
- Re: NewCartoon or NewRibbons Secondary Structure methods don't work with latest updated Mesa 22.2.3 (Wed Jan 25 2023 - 02:10:51 CST)
- David Chalmers
- David Cohen-Tanugi
- David E. Heppner
- David E. Jones
- David F. Green
- David Fischermeier
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- david MARTROU
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- davidiniming .
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- dbg
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- de Waal, Parker
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- Deng, Jinxia (Nancy)
- Denilson F. Oliveira
- DENILSON FERREIRA DE OLIVEIRA
- denilson_at_dqi.ufla.br
- Denis Davydov
- Denis Zhu
- Denise G Teotico
- Denise Teotico
- Denish Poudyal
- i thought I could run a 100 ns NAMD simulation in my laptop for a protein-hormone system containing around 2000 atoms in its pdb file(4lnx.pdb). But even to run a simulation for four hundred fifty thousand steps, it has taken almost 4700 minutes. is this normal or its low? the device has 4 cores with 16 gigs of ram and 4 gigs of gpu(amd). Or any suggestions to run it faster??? (Sun Mar 25 2018 - 20:22:34 CDT)
- deniszhu1991
- Dennis N
- Dennis N Bromley
- How can I easily show ball and stick residues across all molecules and representations? (Thu Jul 18 2013 - 17:07:51 CDT)
- Re: how do I show contacts with XXX angstroms between a protein and a ligand? (Sat Jun 04 2011 - 21:24:26 CDT)
- Re: how do I show contacts with XXX angstroms between a protein and a ligand? (Sat Jun 04 2011 - 13:09:48 CDT)
- Re: how do I show contacts with XXX angstroms between a protein and a ligand? (Sat Jun 04 2011 - 12:14:40 CDT)
- Denny Bromley
- Denys Bashtovyy
- DePuy
- Derek Ng
- Derek R. Ploor
- Derman Baştürk
- Derya Meral
- DESPIAU-PUJO Emilie UJF
- Devanand T
- Re: How to copy/paste a membrane patch to create a larger membrane? (Mon Feb 05 2018 - 09:26:40 CST)
- dhacademic
- DHEERAJ CHITARA
- Dhiraj Srivastava
- Dhritiman Talukdar
- Dian Jiao
- diane lynch
- Dibyadeep Paul
- Dick Medrano
- Diego Enry
- Diego Enry Barreto Gomes
- Diego Gomes
- Re: Two different type of color set for potential map of overlapped molecules (Wed Oct 02 2024 - 14:04:50 CDT)
- Re: compile vmd-1.9.4a57 source - OptiXRenderer.h:84:10: fatal error: optix_math.h: No such file or directory (Wed Jul 31 2024 - 10:19:04 CDT)
- Re: compile vmd-1.9.4a57 source - OptiXRenderer.h:84:10: fatal error: optix_math.h: No such file or directory (Fri Jul 26 2024 - 09:31:43 CDT)
- Re: Problems with ‘Surf’ as a “Drawing method” for protein in VMD installed to a local folder (Thu Apr 11 2024 - 12:56:15 CDT)
- Re: Problems with ‘Surf’ as a “Drawing method” for protein in VMD installed to a local folder (Thu Apr 11 2024 - 11:38:36 CDT)
- Re: Problems with ‘Surf’ as a “Drawing method” for protein in VMD installed to a local folder (Thu Apr 11 2024 - 10:14:05 CDT)
- Re: Can not run VMD in interactive mode on the supercomputer from Mac (Thu Apr 11 2024 - 09:48:49 CDT)
- Re: how to control "offset" and "midpoint" of color scale simultaneously using tk-console (Thu Dec 07 2023 - 09:22:00 CST)
- Diego Granados
- Diego Javier Alonso de Armio
- Diego Vazquez
- Diehl, Alex (NIH/NCI) [V]
- Dieter Blaas
- RE: installation of VIDEOMACH, how to point to the location of the files (Sun Feb 06 2005 - 16:23:26 CST)
- Re: installation of VIDEOMACH, how to point to the location of the files (Fri Feb 04 2005 - 10:22:34 CST)
- Dieter Krachtus
- Diez Fernandez, Amanda
- Dimitrios Mantzalis
- Dimitrov, Alex
- Dimitrova, Maria
- DimitryASuplatov
- dimka
- Ding, L.
- dipak sanap
- Dipesh Bhattarai
- Re: Converting tracker coordinates to molecule coordinate for selection (Fri Feb 12 2010 - 11:57:03 CST)
- Re: Converting tracker coordinates to molecule coordinate for selection (Fri Feb 12 2010 - 09:24:58 CST)
- dipti lele
- Diship Srivastava
- Diss Romain
- Dive, Aniruddha Mukund
- Re: VMD TCL Script to save last frame of a trajectory using bash+tcl scripts (Wed Feb 21 2018 - 12:18:02 CST)
- VMD TCL Script to save last frame of a trajectory using bash+tcl scripts (Mon Feb 19 2018 - 16:37:33 CST)
- Re: TCL script to track molecules moving within a specified region each time frame (Tue May 17 2016 - 11:26:04 CDT)
- Re: TCL script to track molecules moving within a specified region each time frame (Mon May 16 2016 - 12:57:18 CDT)
- divya nayar
- divyabharathi korlepara
- Dmitry A Kondrashov
- Dmitry Kovalsky
- Dmitry Lupyan
- Dmitry Osolodkin
- Dmitry Suplatov
- Re: Problems with ‘Surf’ as a “Drawing method” for protein in VMD installed to a local folder (Thu Apr 11 2024 - 12:02:22 CDT)
- Do Yong Kim
- Do_Ba Duc
- Doaa Saayed
- doan dung
- Dolan, Michael (NIH/NIAID) [C]
- Dolan, Michael A. (NIH/NIAID) [C]
- Domenico Riolfi Barzotto
- Dominic Hayward
- Dominik Bottländer
- Dominik Bottlnder
- Dominik Horinek
- Dominique Compton
- Dominique Mias-Lucquin
- Dominique Vlieghe
- Don Havelberg
- Donald Karr
- dong
- Dong Luo
- Re: bad text display in tk console (ubuntu 8.04 VMD 1.8.7 linux 32 bit) (Wed Jan 20 2010 - 14:01:45 CST)
- Re: bad text display in tk console (ubuntu 8.04 VMD 1.8.7 linux 32 bit) (Wed Jan 20 2010 - 13:48:09 CST)
- Re: bad text display in tk console (ubuntu 8.04 VMD 1.8.7 linux 32 bit) (Wed Jan 20 2010 - 11:12:11 CST)
- Re: bad text display in tk console (ubuntu 8.04 VMD 1.8.7 linux 32 bit) (Wed Jan 20 2010 - 10:17:57 CST)
- bad text display in tk console (ubuntu 8.04 VMD 1.8.7 linux 32 bit) (Fri Jan 15 2010 - 11:30:48 CST)
- Dong Xu
- DongHoon Chung
- dongsheng lei
- Dongsheng Zhang
- Donnie Skinner
- Donovan B.T.
- Doran Bennett
- doug irvine
- Douglas Dahl
- Douglas Houston
- Dourna Jamshideasli
- Dow Hurst
- Dow Hurst DPHURST
- Dr Gavin Seddon
- Dr Nick
- Dr Nicolas Le Novere
- Dr. Dan White
- Dr. Daniel James White PhD
- Re: vmd not starting up on Fedora core 3 linux , InsightII to blame (Wed Jan 12 2005 - 01:33:05 CST)
- Re: vmd not starting up on Fedora core 3 linux , nVidia quadro 980 XGL, nVidia 6629 driver (Wed Jan 12 2005 - 00:53:22 CST)
- Re: vmd not starting up on Fedora core 3 linux , nVidia quadro 980 XGL, nVidia 6629 driver (Tue Jan 11 2005 - 07:42:45 CST)
- Re: vmd not starting up on Fedora core 3 linux , nVidia quadro 980 XGL, nVidia 6629 driver (Mon Jan 10 2005 - 01:20:31 CST)
- Re: vmd not starting up on Fedora core 3 linux , nVidia quadro 980 XGL, nVidia 6629 driver (Fri Jan 07 2005 - 07:12:37 CST)
- vmd not starting up on Fedora core 3 linux , nVidia quadro 980 XGL, nVidia 6629 driver (Fri Jan 07 2005 - 06:13:04 CST)
- vmd not starting up on Fedora core 3 linux , nVidia quadro 980 XGL, nVidia 6629 driver (Fri Jan 07 2005 - 02:15:08 CST)
- vmd not starting up on Fedora core 3 linux , nVidia quadro 980 XGL, nVidia 6629 driver (Thu Jan 06 2005 - 05:27:34 CST)
- ATI fglrx 3.11 drivers for Radeon 8500 LE with linux 2.6 kernel, quad buffered stereo on sony G520??? (Wed Aug 25 2004 - 03:44:24 CDT)
- Re: how to make unique chain pdb identifier of virus capsid 60 mer? (Thu Apr 15 2004 - 09:00:24 CDT)
- Re: how to make whole biological unit / virus capsid from pdb BIOMT records (Tue Apr 06 2004 - 04:12:58 CDT)
- how to make whole biological unit / virus capsid from pdb BIOMT records (Mon Apr 05 2004 - 10:35:06 CDT)
- Dr. David Gregory
- Dr. Luis Rosales Leon
- Dr. Mick Knaggs
- Dr. Paul Fons
- Dr. Peter Schellenberg
- Dr. Seth Olsen
- DR. WOON KAI LIN
- Dr. Y. U. Sasidhar
- Dr. Zaheer-ul-Haq Qasmi
- DreamCatcher
- dstrahs_at_pace.edu
- dtp3+_at_pitt.edu
- Ducasse Laurent
- DUCHER Roland
- Dudo
- Re: How to get all bond angles and bond distances for all atoms in sheet (Wed Sep 03 2014 - 02:00:12 CDT)
- Dusan Racko
- dwang_at_cs.kent.edu
- dwds gerge
- Eamon Caddigan
- Eashan C
- Ebert Maximilian
- RE: Draw cylinder with two different diameters for the endpoints (cone) (Wed Oct 07 2015 - 11:35:27 CDT)
- Draw cylinder with two different diameters for the endpoints (cone) (Wed Oct 07 2015 - 11:21:08 CDT)
- Re: OpenDX file format website down: What do the three values at each grid point represent (Tue Oct 06 2015 - 14:38:43 CDT)
- Re: OpenDX file format website down: What do the three values at each grid point represent (Mon Oct 05 2015 - 10:05:29 CDT)
- OpenDX file format website down: What do the three values at each grid point represent (Fri Oct 02 2015 - 12:36:27 CDT)
- Re: Implicit Ligand Sampling: How to get energy along a reaction coordinate? (Wed Sep 23 2015 - 15:09:55 CDT)
- Ebrahim Mayat
- Ebru Cetin
- Ebru Çetin
- Eckhart Guthhrlein
- Ed Lowe
- ed mendez
- Ed Robertson
- Edelmiro Moman
- Eden Duthie
- Edgar Galicia
- Edith Euan
- Edivaldo Rodrigues
- Edoardo Baldi
- Eduard Schreiner
- Eduardo
- Eduardo Cruz-Chu
- Eduardo Estevez
- EDUARDO JOSÉ AZEVEDO CORREA
- Eduardo Oliveira
- Edward Ditler
- Edward J. Smiley Jr.
- Edward Lyman
- Edward P. Manning
- Edward Patrick Obrien
- Edwina Grove
- ee_at_post.harvard.edu
- effekri_at_infinito.it
- Efthymiou, Christos
- Re: Re: Using BigDCD on Simulation Files Located on Mapped Network Drive (Tue Oct 11 2022 - 19:45:48 CDT)
- Re: Using BigDCD on Simulation Files Located on Mapped Network Drive (Tue Oct 11 2022 - 14:15:52 CDT)
- Automation of Analysis from QwikMD and Loading Trajectory Without Water in QwikMD (Thu Sep 01 2022 - 08:48:31 CDT)
- Re: CaFE Plugin - Didn't Find vDW Parameter for Atom Type HT1 Error (Thu Aug 18 2022 - 15:16:34 CDT)
- Calculate Free Binding Energy of Protein-Protein Complex: CaFE Extension (Tue Jun 28 2022 - 14:26:49 CDT)
- EGIDEA PUTI DEVINA
- ehsan shahini
- ehsan zahedinejad
- Eiros Zamora, Juan
- Eisenhart, Andrew (eisenhaw)
- Ekta Khurana
- eladp_at_hplus.tau.ac.il
- elena ermakova
- Elena Lilkova
- ELENA S SLOBOUNOV
- Elena Slobounov
- elene shopova
- elham sattarinezhad
- Eli Alster
- Elias Ahadi
- Elif Ozkirimli
- Elijah Roberts
- Eliud Oloo
- Eliza Wray
- Elizabeth K. White
- Elizabeth Wait
- Ellis, Matthew
- Emanuel Vamvakopoulos
- Emeline Leproult
- emerson p l
- Emilia Wu
- Emiliano Fratini
- Emiliano Ippoliti
- emiliawu_at_dicp.ac.cn
- Emilio Lence
- Emily Chen
- Emily Moore
- Emma Wu
- Emmanouil_Bambakopoulos
- Emmanuel Baribefe Naziga
- Emmanuel Levy
- Emmanuel Vamvakopoulos
- Emmanuel, Alaina
- emmanuel.levy1_at_free.fr
- emra Heshmati
- Endri Kastrati
- eneas_at_usal.es
- Engelman, Joshua
- Enrico Martinez
- Enrico Santori
- Enzo Claudino
- Enzo Vitale
- EPF (Esben Peter Friis)
- EPF \(Esben Peter Friis\)
- Epiphaniou, Nicholas
- Eric A Brenner
- Eric Brown
- Eric Germaneau
- Eric Grzelak
- Eric H. Lee
- Re: NAMD tutorial for Windows problem reading pgn file from vmd tkconsole (Fri Aug 21 2009 - 17:13:21 CDT)
- Eric Hajjar
- Re: Display the electrostatic character (delphimap) on the structure file (Wed May 24 2006 - 02:48:31 CDT)
- Re: Display the electrostatic character (delphimap) on the structure file (Tue May 16 2006 - 01:51:14 CDT)
- Re: Display the electrostatic character (delphimap) on the structure file (Thu May 11 2006 - 01:18:54 CDT)
- eric hu
- Eric Johnson
- Eric Lang
- Eric Ledieu
- Eric Lovejoy
- Eric Peterson
- Eric Schibli
- Eric Smoll
- function returned by atomselect; use global atomselect function from proc scope (Mon Apr 10 2017 - 10:30:03 CDT)
- function returned by atomselect; use global atomselect function from proc scope (Mon Apr 10 2017 - 10:27:23 CDT)
- Rotate molecular system without rotating objects added with the graphics command (Thu Nov 03 2016 - 17:07:14 CDT)
- Re: "OpenGL Display" and "VMD Main" windows; size and location on launch (Sun Sep 28 2014 - 15:27:09 CDT)
- Erica Smith
- Erik
- Erik Abrahamsson
- Erik Nordgren
- erik vogan
- Erik Winardi
- Erin L.
- Erin Ziegler
- Erkan Tuzel
- Ern Ong
- Calculate the bond and angle energy of a glucosidic linkage using NAMD Energy plugin (Mon Feb 25 2019 - 04:39:21 CST)
- VMD ffTK plugin: Error termination occurred at Gaussian input files generated for water interaction (Sat Jan 20 2018 - 07:09:26 CST)
- ffTK: neutral pyruvate group and charged pyruvate group at beta-D-mannose (Wed Jul 26 2017 - 01:37:37 CDT)
- ffTK: neutral pyruvate group and charged pyruvate group at beta-D-mannose (Wed Jul 26 2017 - 01:40:49 CDT)
- ffTK has halted on error. The optimizer has returned an empty result, indicating an abnormal termination. (Mon Dec 26 2016 - 22:31:47 CST)
- RE: How to determine periodicity and phase shift for ffTK dihedral parameter optimization? (Thu Dec 22 2016 - 18:19:58 CST)
- Ern Seang Ong
- Ern.Ong_at_student.adfa.edu.au
- Ernesto Aleksei Delgado Hurtado
- Ernesto E. Di Iorio
- Ernesto Moreno
- Eros Albertazzi
- Errol Lusk
- Esam Tolba
- Esben A. Gad
- Esra Bozkurt
- Esteban Gabriel Vega Hissi
- Estefania Gonzalez Solveyra
- Estela Gibbs
- Esther Brugger
- Ethan Croitoru
- Euclid Sun
- Eugen Leitl
- Re: [linux-elitists] ATI Radeon support (fwd from deejoe@raccoon.com) (Tue Dec 14 2004 - 03:33:02 CST)
- Re: [MMTK] Visualization to an image file (fwd from hinsen@cnrs-orleans.fr) (Mon Jul 12 2004 - 08:36:58 CDT)
- Eugene Leitl
- Eugene Valkov
- Eugenio Gil
- Eunice Ramirez Melendez
- Evan Thompson
- Evandro Semighini
- Evelyn Maizels
- Re: RSCB assembly formatting change - chain names with hyphens and numbers not recognized in VMD (Fri Feb 18 2022 - 10:14:25 CST)
- Evgeniya Volkova
- Evgeny Bulat
- Ezequiel Quintana Morales
- Fabian Boes
- Fabian Gonzalez
- fabio trovato
- fabri
- fabrizio cleri
- fabrizio.benedetti_at_unil.ch
- Faezeh Pousaneh
- Fahimeh Baftizadeh
- Faisal, H M Nasrullah
- Re: namd-l: Query regarding 'Protein:ligand Standard Binding Free Energies' tutorial (Tue Dec 22 2020 - 20:52:34 CST)
- Query regarding 'Protein:ligand Standard Binding Free Energies' tutorial (Tue Dec 22 2020 - 14:39:15 CST)
- Re: Converting electron density data from .map to .dx in vmd Faisal, H M Nasrullah (Mon Sep 28 2020 - 16:31:59 CDT)
- Converting electron density data from .map to .dx in vmd Faisal, H M Nasrullah (Mon Sep 28 2020 - 13:58:18 CDT)
- Falgun Shah
- fan li
- how to keep the bond , angle , dihedral and improper type after solvating the lammps data (Fri Jun 12 2020 - 14:19:23 CDT)
- Re: Atomselection with the position selected conditions inside the loop is not working properly (Thu Aug 16 2018 - 12:18:18 CDT)
- Re: Atomselection with the position selected conditions inside the loop is not working properly (Thu Aug 16 2018 - 10:24:54 CDT)
- Re: Atomselection with the position selected conditions inside the loop is not working properly (Thu Aug 16 2018 - 08:05:38 CDT)
- Fan,Huajun
- fariba taghavi
- faride badalkhani
- farrokh yousefi
- fatehi_at_eng.uk.ac.ir
- Fateme Aghaei
- Fateme Sadat Emami
- Fatemesadat Emami
- Federico Filomia
- Fei Chen
- Fei Xu
- Felicia Jiang
- Felipe Merino
- Felipe Montecinos
- Felix Frolow
- Felix Rausch
- Felix Rodrigues Gulias
- Feng Chen
- Ferdinand Benton
- Fernanda S.
- Fernandez-Alonso, F (Felix)
- Fernando Amrein
- Fernando Bonilla Millan
- Fernando Vallejos-Burgos
- ffavela_at_fis.cinvestav.mx
- Fikret Aydin
- Filip Persson
- Filippo Federici
- Filippo Federici Canova
- Fiona Reid
- flavio seixas
- Fletcher Quick
- floquet_at_icsn.cnrs-gif.fr
- Florentina Tofoleanu
- Florian Barth
- Florian Haberl
- Florian Mrugalla
- florian.naegele_at_uni-ulm.de
- FOK LO MING
- Forest Jefferson
- Foster, Clay A.
- Fotis Baltoumas
- Re: namd-l: Analysis plugins for Martini Coarse Grained protein simulations (Sat Feb 07 2015 - 05:25:50 CST)
- Re: Dynamical Network Analysis (NetworkView): Changing contact cutoff values for edges (Tue Aug 26 2014 - 11:01:55 CDT)
- fouchni_at_uni-osnabrueck.de
- Fran Villa
- Franca Fraternali
- Francesca Lnstad Bleken
- Francesca Mocci
- Francesca Ricci-Tam
- Francesco Coppola
- Francesco Gervasio
- Francesco Greco
- Francesco Iori
- francesco oteri
- Francesco Pietra
- Fwd: Re: namd-l: Selecting atom of given residue in namdenergy plugin (Wed Apr 19 2023 - 12:41:18 CDT)
- Re: Re: namd-l: Selecting atom of given residue in namdenergy plugin (Wed Apr 19 2023 - 12:17:37 CDT)
- Puzzle with "small molecule" ligand structure in nucleotide environments (Sun Feb 06 2022 - 01:59:52 CST)
- Fwd: Problems with charmm36 modified nucleotides for psfgen and namd (Thu Jan 20 2022 - 08:43:12 CST)
- Fwd: Problems with charmm36 modified nucleotides for psfgen and namd (Thu Jan 20 2022 - 08:31:36 CST)
- Fwd: Fwd: namd-l: Re: scripts to generate initial boxes of solvents (Tue Jul 07 2020 - 01:58:10 CDT)
- Fwd: Fwd: namd-l: Re: scripts to generate initial boxes of solvents (Mon Jul 06 2020 - 11:57:16 CDT)
- Fwd: unwap/wrap failure in recomposing splitted system from periodic cells (Fri Jun 12 2015 - 10:57:06 CDT)
- Fwd: unwap/wrap failure in recomposing splitted system from periodic cells (Fri Jun 12 2015 - 11:13:50 CDT)
- Re: unwap/wrap failure in recomposing splitted system from periodic cells (Fri Jun 12 2015 - 10:53:34 CDT)
- Re: unwap/wrap failure in recomposing splitted system from periodic cells (Fri Jun 12 2015 - 02:33:33 CDT)
- unwap/wrap failure in recomposing splitted system from periodic cells (Thu Jun 11 2015 - 12:24:23 CDT)
- Re: FFTK most probably doesn't work with molecules containing new atom types (Sun Dec 14 2014 - 03:26:50 CST)
- Re: FFTK most probably doesn't work with molecules containing new atom types (Sat Dec 13 2014 - 16:44:12 CST)
- Fwd: Re: namd-l: problems with in text mode towards pdf and pdb files (Fri Nov 21 2014 - 10:42:05 CST)
- Re: namd-l: Re: FFTK VMD plugin issue (arising from VECSCALE TCL issues of either NAMD or VMD ?) (Tue Jun 05 2012 - 12:54:05 CDT)
- FFTK VMD plugin issue (arising from VECSCALE TCL issues of either NAMD or VMD ?) (Tue Jun 05 2012 - 02:16:40 CDT)
- Fwd: molefacture "force tetrahedral" failure: SOLVED with chimera-vmd (Wed May 04 2011 - 02:45:21 CDT)
- Fwd: autopsf-patches C++ error 'expected integer but got "" ""' SOLVED, MY FAULT (Fri Feb 25 2011 - 07:59:56 CST)
- Re: namd CG minimization error: unable to find angle parameters for nxg nxx nxg (Fri Dec 11 2009 - 09:52:43 CST)
- francesco quilli
- FRANCESCO TORRICELLA
- Francis Reyes
- francisca andrea salas sepulveda
- Francisco Jos Taberner Sanchis
- Francisco Ramos
- Francois Martz
- francy_at_mvcch3.unica.it
- Frank Barry
- Frank Zack
- Franois-Xavier Coudert
- Fred (Rui FENG)
- Fred de Lamotte
- Fred Moore
- Fred Salsbury
- Freda Lim (IHPC)
- Frederick R. Phelan Jr.
- Frederick Sachs
- Frederico De Santana Pontes
- Fredrik Sjunnesson
- Fujie Tang
- fulvio ciriaco
- Fung Wai Keung
- Funzo_at_seznam.cz
- Fux Samuel (ID SIS)
- fvlieffe
- FX
- Re: Early VMD 1.9.4 alpha builds for MacOS X Catalina (e.g., 10.15.4) (Sun May 03 2020 - 07:16:23 CDT)
- Re: Early VMD 1.9.4 alpha builds for MacOS X Catalina (e.g., 10.15.4) (Tue Apr 28 2020 - 13:18:37 CDT)
- Re: Problem with Surf representation in the latest version macOS Catalina (Tue Apr 28 2020 - 11:35:09 CDT)
- Re: Problem with Surf representation in the latest version macOS Catalina (Tue Apr 28 2020 - 05:07:10 CDT)
- Re: Early VMD 1.9.4 alpha builds for MacOS X Catalina (e.g., 10.15.4) (Sun Apr 26 2020 - 14:49:37 CDT)
- Re: Early VMD 1.9.4 alpha builds for MacOS X Catalina (e.g., 10.15.4) (Sun Apr 26 2020 - 04:49:57 CDT)
- Re: Early VMD 1.9.4 alpha builds for MacOS X Catalina (e.g., 10.15.4) (Sun Apr 26 2020 - 04:27:14 CDT)
- Re: Early VMD 1.9.4 alpha builds for MacOS X Catalina (e.g., 10.15.4) (Sat Apr 25 2020 - 08:25:09 CDT)
- Re: Early VMD 1.9.4 alpha builds for MacOS X Catalina (e.g., 10.15.4) (Sat Apr 18 2020 - 07:16:45 CDT)
- Re: Early VMD 1.9.4 alpha builds for MacOS X Catalina (e.g., 10.15.4) (Fri Apr 17 2020 - 17:42:29 CDT)
- Re: Segfault in VMD 1.9.4a38 in DrawMolItem::draw_volume_isosurface_points (Fri Apr 03 2020 - 10:26:17 CDT)
- Segfault in VMD 1.9.4a38 in DrawMolItem::draw_volume_isosurface_points (Fri Apr 03 2020 - 06:18:01 CDT)
- Re: "measure symmetry" and SymmetryTools fail to find simple symmetry (Fri Nov 22 2013 - 07:13:43 CST)
- Re: "measure symmetry" and SymmetryTools fail to find simple symmetry (Wed Nov 20 2013 - 18:00:44 CST)
- Re: "measure symmetry" and SymmetryTools fail to find simple symmetry (Sat Nov 16 2013 - 15:58:20 CST)
- FX Coudert
- FyD
- Empirical force fields: release new version of RED Server Dev/PyRED (Mon May 05 2014 - 06:07:18 CDT)
- G.H. Zuo
- Gabby Leonard
- Gabi Heller
- gaborekt_at_duq.edu
- Gabrielle Garcia
- gadde suneetha
- Gadi Oron
- Gaetano Calabr
- gagandeep singh
- GAGANJYOT KAUR BAKSHI
- Gajanan Kanagalingam
- Galip Gurkan Yardimci
- Gamot, Ritchie
- ganderle_at_optonline.net
- Ganesh Kamath
- Ganesh Shahane
- Ganne, Akshatha
- Gao, Fan, Ph.D.
- Gard Nelson
- Gardezi,Shahbaz
- Garf
- gargiulo
- Garold Murdachaew
- Gary Turner
- gaurav nandrajog
- Gaurav Sharma
- Gavin Melaugh
- Gavin Murphy
- Gavin Seddon
- Gawtak Kim
- gbellesia_at_chem.ucsb.edu
- gcmc jie
- geetha9999_at_aol.com
- Geist, Norman
- Re: CaFE Plugin - Didn't Find vDW Parameter for Atom Type HT1 Error (Thu Aug 18 2022 - 12:50:18 CDT)
- Gemma Kinsella
- Genform GK
- Geng
- genie lfs
- Geoff Wood
- Georcki Ropon
- Re: Using BigDCD on Simulation Files Located on Mapped Network Drive (Thu Oct 13 2022 - 14:31:37 CDT)
- Georg Spiekermann
- George Gerogiokas
- George Lai
- George M Giambasu
- George Madalin Giambasu
- George Mogami
- George Omolloh
- George Patargias
- George Tzotzos
- Georgia Tsagkaropoulou
- Georgios Gerogiokas
- Georgios Scheiner-Bobis
- Georgios Villias
- Gerald Mathias
- gergely.gyimesi_at_ibmm.unibe.ch
- Germain Salvato Vallverdu
- Germain Vallverdu
- Germn Andrs Mio
- Gert Peters
- Ghaleb El Masri
- Ghalib Bello
- Ghazaleh Zamani Maimian
- Ghislain Deslongchamps
- Ghosh, Shreya
- Giacomo Fiorin
- Re: restarting calculations anytime within Equilibration and MD simulations steps in QwikMD (Tue Apr 30 2024 - 16:09:48 CDT)
- Re: restarting calculations anytime within Equilibration and MD simulations steps in QwikMD (Tue Apr 30 2024 - 14:42:21 CDT)
- Re: VMD Compilation with LEPTON & C++11 to support COLVARS "customFunction" (Fri Mar 05 2021 - 11:46:59 CST)
- Re: FFTK: What is the correct charge calculation setup for carbonyl compounds (Wed Feb 19 2020 - 10:47:26 CST)
- Re: Problem While Visualising the Trajectory File from LAMMPS Simulation (Sat Jun 01 2019 - 18:28:42 CDT)
- Re: How to fix the position of the lipid bilayer in the trajectories (Thu Mar 14 2019 - 09:46:31 CDT)
- Re: How to fix the position of the lipid bilayer in the trajectories (Wed Mar 13 2019 - 15:34:12 CDT)
- Re: Atomselection with the position selected conditions inside the loop is not working properly (Thu Aug 16 2018 - 09:09:27 CDT)
- Re: VMD TCL Script to save last frame of a trajectory using bash+tcl scripts (Wed Feb 21 2018 - 13:07:40 CST)
- Re: Can specden produce the autocorrelation and not only the powerspectrum? (Wed Feb 07 2018 - 08:51:27 CST)
- Re: Can specden produce the autocorrelation and not only the powerspectrum? (Tue Feb 06 2018 - 13:10:44 CST)
- Re: How to copy/paste a membrane patch to create a larger membrane? (Mon Feb 05 2018 - 08:55:50 CST)
- Re: VMD ffTK: The determination of a correct spin multiplicity value (Mon Jan 22 2018 - 08:31:45 CST)
- Gianfranco Abrusci
- GIANG NGUYEN
- Gianluca Interlandi
- Re: Feedback wanted from Linux VMD users with ATI/AMD graphics chipsets (Fri Nov 11 2011 - 13:01:17 CST)
- Re: Feedback wanted from Linux VMD users with ATI/AMD graphics chipsets (Fri Nov 11 2011 - 12:30:08 CST)
- Gianluca Lattanzi
- Gianluca Santarossa
- Ginger Emel
- Gino
- Giovanni
- Giovanni Bellesia
- Re: Changing the Index values of a molecule (the differenece between gro and pdb files) (Wed Aug 15 2007 - 13:32:56 CDT)
- Giovanni Settanni
- Gitte Iversen
- giulia palermo
- Giuseppe Ermondi
- Giuseppe La Rosa
- GIUSEPPE LEONARDO LICARI
- Giuseppe Licari
- giuseppe_at_ks.uiuc.edu
- Gkourmpis, Thomas
- Glenn Johnson
- Gloria Rendon
- Gmail2
- Goedde, Chris
- Re: [EXT] placing graphics objects at fixed locations on the display (Tue Oct 06 2020 - 15:32:23 CDT)
- Goldsmith, Jacob
- Gonzalez, Aaron
- Gopinath Subramanian
- Gordon S Freeman
- Gordon Wells
- Gorka Lasso
- gorka lasso via LinkedIn
- Goutham
- gozorows_at_uci.edu
- gpat_at_bioacademy.gr
- Grace Brannigan
- Grace Clay
- Graham Jackson
- GRANT KENNY
- Grant Schauer
- Grazia Daminelli
- greddy1_at_umd.edu
- Greg Moore
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- Gregorio Fernandez
- Greipel.Joachim_at_mh-hannover.de
- Greta Bush
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- Grischa Meyer
- Grzegorz Wieczorek
- gschlau-cohen_at_berkeley.edu
- gtg991m_at_mail.gatech.edu
- Gu, Wenze
- Guanglei Cui
- Re: X_ChangeProperty: BadValue (integer parameter out of range for operation) 0x40 (Tue Jan 08 2008 - 14:40:43 CST)
- Guanyu Wang
- Gudrun Gygli
- Guenegou, Guillaume [ORDFR]
- Guido Polles
- Guilherme da Silva
- guillaume.santini_at_free.fr
- GUIXA GONZALEZ, RAMON
- Gulce Kalyoncu
- Gumbart, James C
- Gumbart, JC
- Re: Re: FFTK partial charge assignment weak acid ONOH (HNO2) - Water Shift settings (Sun Oct 06 2024 - 07:26:26 CDT)
- Re: fftk, ORCA, Bond and Angle Optimization, error As a subsequent Frequencies calculation has been requested (Thu Jul 25 2024 - 12:46:36 CDT)
- Re: CHARMM36 and water: can the H-H "bond" be added to the wat.top file used by solvate.tcl? (Wed Jul 05 2023 - 12:32:43 CDT)
- Re: Re: ffTK Opt Torsions Refine Section EDIT ENTRY SECTION PROBLEM (Tue Mar 28 2023 - 19:31:17 CDT)
- Re: Re: ffTK Opt Torsions Refine Section EDIT ENTRY SECTION PROBLEM (Tue Mar 28 2023 - 18:54:11 CDT)
- Re: Re: ffTK Opt Torsions Refine Section EDIT ENTRY SECTION PROBLEM (Tue Mar 28 2023 - 18:04:16 CDT)
- Re: Re: ffTK Opt Torsions Refine Section EDIT ENTRY SECTION PROBLEM (Tue Mar 28 2023 - 18:06:57 CDT)
- Re: Re: No ffTK .gau Extension in Determine File Type in VMD for Visualization Problem? (Thu Mar 23 2023 - 13:29:13 CDT)
- Re: Re: No ffTK .gau Extension in Determine File Type in VMD for Visualization Problem? (Thu Mar 23 2023 - 10:50:53 CDT)
- Re: Re: No ffTK .gau Extension in Determine File Type in VMD for Visualization Problem? (Wed Mar 22 2023 - 16:40:10 CDT)
- Re: ffTK can't use empty string as operand of "*" vmd194a53win64-SetupV7.exe (Sat Apr 09 2022 - 20:40:03 CDT)
- Re: ffTK can't use empty string as operand of "*" vmd194a53win64-SetupV7.exe (Thu Apr 07 2022 - 08:34:27 CDT)
- Re: Early access to VMD builds with full-time interactive ray tracing display mode (Tachyon RTX RTRT) (Tue Oct 19 2021 - 19:58:12 CDT)
- Re: Couldn't read internal coordinate table and list index out of range (Tue Feb 23 2021 - 19:28:33 CST)
- Re: Couldn't read internal coordinate table and list index out of range (Tue Feb 23 2021 - 19:00:32 CST)
- gumbart_at_ks.uiuc.edu
- Gunnar Schroeder
- Guo Zhi
- Re: How to let vmd do secondary structure judgement for each frame and render it on play movie? (Sat Dec 16 2006 - 02:59:41 CST)
- Re: How to let vmd do secondary structure judgement for each frame and render it on play movie? (Sat Dec 16 2006 - 00:31:00 CST)
- Guo, Jiasen (MU-Student)
- Gupta, S.S. (Somil)
- gurpreet singh
- Gurunath Katagi
- gurvisha sandhu
- Gustavo Gust
- Gustavo Mercier
- Gustavo Scheiffer
- Gustavo Seabra
- Guy Coates
- guy.baudoux_at_gskbio.com
- Gyimesi Gergely
- gke aye gven
- H Q
- H. Lee
- h9826299_at_hkusua.hku.hk
- Haberl Florian
- Habib.Alehossein_at_csiro.au
- Hai-Jun Su
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- haider abbas
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- Hall, Lisa Michelle
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- Hamid
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- Hans Martin Senn
- Hao Sun
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- Harindar Keer
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- HEMANTH H 18310019
- Hemanth Vemuri
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- henri mone
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- Hess, Bret
- hgkrug1_at_gmail.com
- QwikMD QM Tut - FATAL ERROR: Error running command for QM forces calculation (Mon Sep 12 2022 - 08:38:15 CDT)
- QwikMD QM Tut - FATAL ERROR: Error running command for QM forces calculation (Fri Sep 09 2022 - 03:46:55 CDT)
- Hideki Hatanaka
- Hideya Nakamura
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- Hideyuki Miyatake
- hifiber7_at_compuserve.com
- Him Bandhu Upadhyay
- RE: Application Error message during dihedral optimization using FFTK (Fri Oct 19 2012 - 08:48:47 CDT)
- RE: Error message -" cannot find NAMD binary files" during parameterization using FFTK plugin. (Thu Oct 11 2012 - 15:02:16 CDT)
- RE: Error message -" cannot find NAMD binary files" during parameterization using FFTK plugin. (Thu Oct 11 2012 - 14:43:10 CDT)
- Error message -" cannot find NAMD binary files" during parameterization using FFTK plugin. (Thu Oct 11 2012 - 12:41:59 CDT)
- Re: High Bound charge values missing during charge optimization in FFTK (Fri Sep 28 2012 - 09:42:57 CDT)
- himanshu chandola
- Himanshu Joshi
- Himanshu Khandelia
- Re: changing certain dihedral angles while keeping rest of molecule fixed (Wed Jun 06 2007 - 10:02:54 CDT)
- changing certain dihedral angles while keeping rest of molecule fixed (Wed Jun 06 2007 - 04:37:01 CDT)
- Re: problem using bigdcd.tcl script does not run beyond the first frame no error reported (Mon May 07 2007 - 10:25:56 CDT)
- hinsen_at_dsm-mail.saclay.cea.fr
- hinsen_at_llb.saclay.cea.fr
- HIRA BATOOL
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- Hlder Bandarra Tavares
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- I. Camps
- iamcool777able .
- Ian
- Ian Stokes-Rees
- Re: VMD questions about animating residue distance lines and contact maps (Fri Aug 13 2010 - 10:30:15 CDT)
- VMD questions about animating residue distance lines and contact maps (Thu Aug 12 2010 - 15:56:18 CDT)
- Re: PC suitable for visualisation of large systems, maximum namuber of atoms in a .pdb file (Wed Jul 21 2010 - 12:20:56 CDT)
- Re: PC suitable for visualisation of large systems, maximum namuber of atoms in a .pdb file (Wed Jul 21 2010 - 07:07:51 CDT)
- Re: VMD failure of RMSD Traj Tool, time index on each rendered frame, and crash (Tue Jul 20 2010 - 11:00:11 CDT)
- ianboru_at_email.arizona.edu
- IBC strbio
- Ibrahim Dunga
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- ikek70
- ILJA Khavrutskii
- Iman Jeddi
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- Re: accessing bonds angles dihedrals etc lists after PSF file is read into VMD (Mon Jan 26 2009 - 16:10:39 CST)
- Iman Salehinia via LinkedIn
- Indrajit Deb
- indu purushothaman
- INPE (Ingrid Viveka Pettersson)
- Insight II
- Ins Sousa
- Ioana Cozmuta
- ioana_at_pegasus.arc.nasa.gov
- Irem Altan
- Irena Tuszyska
- Irene Newhouse
- pbctools & Desmond trajectory with protein units 'jumping' into other cells (Mon Jan 10 2011 - 13:22:26 CST)
- Irina Tuszynska
- ISHRAT JAHAN
- Ishwar Hosamani
- Ismail, Mohd F.
- Isralewitz, Barry
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- Izrailev, Sergei
- J T
- J. Juraszek
- J. Matthew Franklin
- J. Nathan Scott
- J. Rui Rodrigues
- problem with IED: 'numpy.ndarray' object has no attribute 'typecode' (Wed Apr 07 2010 - 14:01:37 CDT)
- Re: RuntimeError: tk.h version (8.4) doesn't match libtk.a version (8.5) (Tue Apr 06 2010 - 08:11:00 CDT)
- RuntimeError: tk.h version (8.4) doesn't match libtk.a version (8.5) (Thu Apr 01 2010 - 11:51:06 CDT)
- J. Zheng
- Jaap Kroes
- Jacinto S.
- Jack Bulat
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- Jack Howarth
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- Jackson Gois
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- Jacob Phlsgaard
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- Jacopo Sgrignani
- jacopo.sgrignani_at_unifi.it
- Jacqueline Cawthray
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- Jake .
- jake wernik
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- James E. Magee
- james Fernandez
- James Haven
- James Irving
- Re: Mac OSX crash with bus error/segmentation fault upon loading pdb/dcd (Mon Jun 30 2008 - 18:10:13 CDT)
- James Keener
- James Kress
- RE: query on how to allow the protein to interact with the water molecules (Mon Oct 07 2019 - 10:06:23 CDT)
- RE: Rendering high quality obj, x3d and other files for use in other 3D representation systems (Sat Apr 02 2016 - 23:11:04 CDT)
- RE: Rendering high quality obj, x3d and other files for use in other 3D representation systems (Sat Apr 02 2016 - 22:54:03 CDT)
- RE: Rendering high quality obj, x3d and other files for use in other 3D representation systems (Sat Apr 02 2016 - 22:14:08 CDT)
- James Lord
- James MacDonald
- Re: Re: vmd not starting up on Fedora core 3 linux , InsightII to blame (Fri Mar 04 2005 - 06:33:28 CST)
- James Marsh
- James Melville
- James Rustad
- James Ryley
- James Starlight
- James Stevens
- james tomomi macdonald
- James.Beavis_at_csiro.au
- jamesgiacmo_at_aol.com
- jampani srinivas
- Jan Brezovsky
- Ph.D. candidate position in biomolecular modeling or bioinformatics (Wed Jul 04 2018 - 05:33:36 CDT)
- Ph.D. and Post-doc positions in molecular simulations and structural bioinformatics (Mon Mar 05 2018 - 11:10:28 CST)
- Jan F. Totz
- Jan Janssen
- Jan Rychter
- Jan Saam
- Re: Possible error in aligning/computing RMSD of 2 molecules with three or two atoms (Thu Mar 23 2006 - 18:36:28 CST)
- Re: Possible error in aligning/computing RMSD of 2 molecules with three or two atoms (Thu Mar 23 2006 - 16:17:29 CST)
- Re: Possible error in aligning/computing RMSD of 2 molecules with three or two atoms (Thu Mar 23 2006 - 16:11:55 CST)
- Re: Possible error in aligning/computing RMSD of 2 molecules with three or two atoms (Thu Mar 23 2006 - 15:30:53 CST)
- Jan-Philip Gehrcke
- Jana Black
- Jana, Suvamay
- Janakiraman Balachandran
- Janani.S
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- javacfish
- Javad Azadi
- JAVAD NOROOZI
- Javaria Ahmad
- Javaria Ahmed
- Javier Badilla
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- Javier Ivan Wong Romero
- Javier Sacristan
- javier.vallejos_at_correo.usach.cl
- Jawahar Neelankatan
- Jay Lee
- Jay McAliley
- Jay Shore
- jayant james
- jayant_jacques
- Jayendra Balasubramanian
- Jayne Wallace
- jbaucom_at_unity.ncsu.edu
- JC Gumbart
- Re: FFTK - issue after hessian loading during bonds/angles optimization (Mon Aug 10 2020 - 16:19:18 CDT)
- Re: Action halted on error in ffTK: The following output QM was not recognized (Tue Jun 09 2020 - 20:12:50 CDT)
- Re: Action halted on error in ffTK: The following output QM was not recognized (Tue Jun 09 2020 - 18:03:55 CDT)
- Re: Action halted on error in ffTK: The following output QM was not recognized (Tue Jun 09 2020 - 12:27:22 CDT)
- Re: FFTK: What is the correct charge calculation setup for carbonyl compounds (Thu Feb 20 2020 - 08:10:32 CST)
- Re: Fwd: Problem with Loading Bond Angle Optimization Gaussian .log file into the fftk (Fri Nov 03 2017 - 10:39:20 CDT)
- Re: Fwd: Problem with Loading Bond Angle Optimization Gaussian .log file into the fftk (Fri Oct 20 2017 - 17:15:01 CDT)
- Re: ffTK has halted on error. The optimizer has returned an empty result, indicating an abnormal termination. (Sat Dec 31 2016 - 22:12:49 CST)
- Re: ffTK has halted on error. The optimizer has returned an empty result, indicating an abnormal termination. (Wed Dec 28 2016 - 16:52:28 CST)
- Fwd: Inviting applications for a new PhD program in Quantitative Biosciences at Georgia Tech (Wed Sep 09 2015 - 18:15:34 CDT)
- Re: measure Hbond and orient (with vec {0 0 1}) of a selected molecule (Fri Apr 25 2014 - 15:27:30 CDT)
- Re: ffTK generated Gaussian file puts "atoms too close" and Gaussian fails to run (Tue Apr 08 2014 - 15:05:23 CDT)
- Re: FFTK, pyrrolidine parametrization bonded parameters- issue with Hessian (Tue Oct 22 2013 - 10:23:45 CDT)
- Re: FFTK, pyrrolidine parametrization bonded parameters- issue with Hessian (Fri Oct 18 2013 - 13:28:42 CDT)
- RE: FFTK, pyrrolidine parametrization bonded parameters- issue with Hessian (Thu Oct 17 2013 - 06:32:24 CDT)
- RE: charge exceed the range between Low bound and High bound in ffTK charge optimization (Fri Jun 07 2013 - 07:40:49 CDT)
- RE: ABF tutorial: Methane-Hydration water going -> Water in gas phase? (Sat May 04 2013 - 08:36:41 CDT)
- RE: ABF tutorial: Methane-Hydration water going -> Water in gas phase? (Sat May 04 2013 - 00:29:25 CDT)
- Re: namd-l: Assigning Partial Charges to FE in Active Site Superoxide Dismutase. (Wed Jan 23 2013 - 14:26:59 CST)
- jcorradi_at_criba.edu.ar
- Jeams Anderson
- Jean Richelle
- Jean-Patrick Francoia
- jeela keel
- Jeeno Jose
- jeevan gc
- Jeevan Patra
- Jeff Ames
- Jeff Hoch
- Jeff Saxon
- Jeff Taylor
- Jeff Ulrich
- Jeffery
- Jeffrey A Tibbitt
- Re: Is there a way to create atom selection for a list of atom indices? (Thu Mar 29 2018 - 03:29:19 CDT)
- Is there a way to create atom selection for a list of atom indices? (Thu Mar 29 2018 - 01:43:43 CDT)
- Jeffrey D. Hartgerink
- Jeffrey Gardner
- Jeffrey Potoff
- Jeffrey Sanders
- Jeffrey Tseng
- Jeffry D Madura
- Jehanzeb Hameed
- JeJoon Yeon
- Jelle van Sijl
- jen hsin
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- Jen-Chang Chen
- Jennie Thomas
- Jennifer A Carvajal
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- Jennifer Lardge
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- Jeremiah Babcock
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- Jeremías Corradi
- Jeremas Corradi
- jermy23_at_hushmail.com
- Jernej Zidar
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- Jessica Padden
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- Jester Itliong
- jestin mandumpal
- Jevgenij Raskatov
- jfgaff_at_ncsu.edu
- jgrime_at_uchicago.edu
- jhamre
- Jhonatam Cordeiro Rodrigues
- JhonY. I.
- Jia-Yang Lim
- Jiabin You
- Jiabo Li
- Jiajian Li
- jiali wang
- Jian Dai
- Jian Zou
- Jiancong Xu
- Jianhui Tian
- Jianping Lin
- Jiao, Dian NMN (-EXP)
- Jiapu.Zhang_at_csiro.au
- Jiawei Xu
- Jill Vickery
- Jim
- Jim Caldwell
- Jim Fonseca
- Jim Kress
- Jim Nettles
- Jim Parker
- Re: ffTK generated Gaussian file puts "atoms too close" and Gaussian fails to run (Wed Apr 23 2014 - 07:13:37 CDT)
- Re: ffTK generated Gaussian file puts "atoms too close" and Gaussian fails to run (Fri Apr 04 2014 - 14:32:24 CDT)
- ffTK generated Gaussian file puts "atoms too close" and Gaussian fails to run (Fri Apr 04 2014 - 05:42:33 CDT)
- Re: Install VMD binary with CUDA, CUDA card detected but then error "no CUDA-capable device is available"--Solved (Sun Oct 11 2009 - 21:31:05 CDT)
- Jim Pfaendtner
- Jim Phillips
- Re: Fwd: Re: namd-l: problems with in text mode towards pdf and pdb files (Fri Nov 21 2014 - 12:50:22 CST)
- Re: Fwd: Re: namd-l: problems with in text mode towards pdf and pdb files (Fri Nov 21 2014 - 10:54:20 CST)
- Re: [Stefan_Franzen@ncsu.edu: Patch for deoxy and dideoxy nucleotides] (Wed Feb 15 2012 - 10:24:11 CST)
- Re: Rebuilding lipid from headgroup coordinates only using psfgen, some atoms put on origin (Sat Sep 08 2007 - 21:56:51 CDT)
- Jim Shepherd
- jim_at_wellyes.com
- jimkress_58_at_kressworks.org
- Jimmie Corona
- jin
- Jin Wen
- Jinasena Hewage
- Jindal Shah
- Jing
- jing liang
- jing xia
- Jinhua Zhang
- jirasak wong-ekkabut
- Jiri Polach
- Jirui Yang
- jiwu liu
- jj mm
- jmp17_at_duke.edu
- jnsong
- Re: Do psf generated by psfgen and psf produced by "$sel writepsf" function in VMD have different impact on MD simulation using NAMD? (Tue May 17 2011 - 21:42:42 CDT)
- Re: Do psf generated by psfgen and psf produced by "$sel writepsf" function in VMD have different impact on MD simulation using NAMD? (Tue May 17 2011 - 21:32:52 CDT)
- jo hanna
- jo333_4_at_lawrence-lca.co.uk
- Joaim Swedberg
- Joakim Swedberg
- Joan Winslow
- Joanne Hanna
- Joao Ribeiro
- Re: Charm++ fatal error: FATAL ERROR: UNABLE TO FIND BOND PARAMETERS FOR CG321 NG301 (ATOMS 6407 6408) .. ERROR) Error connecting to localhost on port 3000 (Mon Dec 16 2019 - 09:26:08 CST)
- Re: query on how to allow the protein to interact with the water molecules (Tue Oct 08 2019 - 09:01:51 CDT)
- Re: Generate QM Region Topology in QwikMD for metal ions to perform QM/MM (Tue Jul 16 2019 - 09:29:31 CDT)
- Re: Error during minimizazion - Number of atoms in fixed atoms PDB... (Tue Jun 18 2019 - 09:38:50 CDT)
- Joao Vieira-Ribeiro
- Joaquim Rui de Castro Rodrigues
- RE: Discrepancy in value of dihedral angles of a sugar molecule by VMD tools (Thu Jul 22 2021 - 09:56:53 CDT)
- RE: Shifting the Geometric Center of entire set of molecules to origin (Wed Nov 04 2015 - 06:14:13 CST)
- RE: How to write coordinates to a pdb without replacing existing entries (Sun Mar 08 2015 - 13:50:57 CDT)
- RE: How to write coordinates to a pdb without replacing existing entries (Sun Mar 08 2015 - 11:41:18 CDT)
- Joaquim Rui Rodrigues
- Jocelyn Rodgers
- Jodi Ann Hadden
- Joe Huang
- Joe Janicki
- Joe Konecny
- Joe Zhou
- Joel Subach
- Re: ffTK Opt Charges Tab QM Target Data Section OUTPUT FILES Inquiry (Sat Dec 14 2024 - 11:45:39 CST)
- Re: ffTK Opt Charges Tab QM Target Data Section OUTPUT FILES Inquiry (Sat Dec 14 2024 - 11:43:52 CST)
- Re: Anyone Completed ffTK Calc Bonded Tab using ORCA gbw instead of Gaussian chk? (Mon Nov 25 2024 - 03:57:21 CST)
- Re: ffTK Water Int Tab .inp File dropping the Charge Value from -2 to 0 Inquiry? (Sat Nov 09 2024 - 23:35:46 CST)
- Re: ffTK Water Int Tab .inp File dropping the Charge Value from -2 to 0 Inquiry? (Fri Nov 08 2024 - 03:52:27 CST)
- Re: ffTK Water Int Tab .inp File dropping the Charge Value from -2 to 0 Inquiry? (Tue Nov 05 2024 - 03:28:07 CST)
- ffTK Water Int Tab .inp File dropping the Charge Value from -2 to 0 Inquiry? (Mon Nov 04 2024 - 09:16:41 CST)
- Re: fftk, ORCA, Bond and Angle Optimization, error As a subsequent Frequencies calculation has been requested (Thu Jul 25 2024 - 13:05:15 CDT)
- Re: ffTK Water Int Tab .inp File Flipping a Waters Coordinates Inquiry (Mon Jul 15 2024 - 09:09:18 CDT)
- Re: ffTK Water Int Tab .inp File Flipping a Waters Coordinates Inquiry (Sun Jul 14 2024 - 12:19:46 CDT)
- Re: is ! RI-MP2 6-31G* TightSCF opt autoaux rijcosx compatibile with ffTK CHARMM INQUIRY (Sat May 11 2024 - 10:55:20 CDT)
- Re: Adding an Implicit Solvation Compatible with below ffTK suggested Methods INQUIRY (Sat May 11 2024 - 10:49:03 CDT)
- Re: Adding an Implicit Solvation Compatible with below ffTK suggested Methods INQUIRY (Wed May 08 2024 - 14:06:02 CDT)
- Adding an Implicit Solvation Compatible with below ffTK suggested Methods INQUIRY (Tue May 07 2024 - 13:26:58 CDT)
- is ! RI-MP2 6-31G* TightSCF opt autoaux rijcosx compatibile with ffTK CHARMM INQUIRY (Sat Apr 27 2024 - 02:03:24 CDT)
- Re: Anyone Completed ffTK Calc Bonded Tab using ORCA gbw instead of Gaussian chk? (Thu Feb 22 2024 - 03:08:29 CST)
- Re: Re: ffTK Parameter Selection i.e. just Scan and Opt Torsion Selection Viable? (Tue Feb 20 2024 - 07:33:37 CST)
- Re: ffTK Opt Torsions Tab Hysteresis Problem in the QM Calculation Inquiry or Phase Periodicity error? (Tue Feb 20 2024 - 06:06:29 CST)
- Re: ffTK Parameter Selection i.e. just Scan and Opt Torsion Selection Viable? (Tue Feb 20 2024 - 06:09:32 CST)
- Re: ffTK Tabs for Just Dihedral Optimization Can I Just Use Scan and Opt Tabs Inquiry? (Tue Feb 20 2024 - 06:04:23 CST)
- Re: Anyone Completed ffTK Calc Bonded Tab using ORCA gbw instead of Gaussian chk? (Tue Feb 20 2024 - 05:43:11 CST)
- Re: Anyone Completed ffTK Calc Bonded Tab using ORCA gbw instead of Gaussian chk? (Tue Feb 20 2024 - 02:01:03 CST)
- Anyone Completed ffTK Calc Bonded Tab using ORCA gbw instead of Gaussian chk? (Mon Feb 19 2024 - 14:08:30 CST)
- Re: ffTK Opt. Charge Run QM Target Data WATER INTERACTION ENERGY DATA INQUIRY (Fri Feb 09 2024 - 11:47:09 CST)
- ffTK Opt. Charge Run QM Target Data WATER INTERACTION ENERGY DATA INQUIRY (Tue Feb 06 2024 - 09:43:16 CST)
- Re: ffTK Opt. Charge Run Optimization Error PSF File Problem INQUIRY (Mon Feb 05 2024 - 11:32:15 CST)
- Re: ffTK Opt. Charge Run Optimization Error PSF File Problem INQUIRY (Mon Feb 05 2024 - 11:39:02 CST)
- Re: ffTK Water Interactions Ligand Atom Hydrogen Bond Acceptors Acting as Donors Inquiry (Thu Dec 14 2023 - 06:19:45 CST)
- Re: ffTK vmd Index Atom Numbering via ORCA .inp and .out Files Inquiry (Wed Dec 13 2023 - 04:30:37 CST)
- Re: ffTK vmd Index Atom Numbering via ORCA .inp and .out Files Inquiry (Wed Dec 13 2023 - 03:46:25 CST)
- ffTK Tabs for Just Dihedral Optimization Can I Just Use Scan and Opt Tabs Inquiry? (Fri Oct 27 2023 - 11:18:02 CDT)
- ffTK Scan Torsions Scan +/-and Step Size Inquiry which are Best Values? (Fri Oct 27 2023 - 11:12:38 CDT)
- Re: ffTK Opt Torsions Tab Hysteresis Problem in the QM Calculation Inquiry or Phase Periodicity error? (Thu Oct 26 2023 - 11:09:03 CDT)
- Re: ffTK Opt Torsions Refine Section i.e. PERIODICITY, PHASE SHIFT Values? (Tue Oct 24 2023 - 10:40:24 CDT)
- ffTK Opt Torsions Refine Section i.e. PERIODICITY, PHASE SHIFT Values? (Sun Oct 22 2023 - 07:21:10 CDT)
- ffTK Parameter Selection i.e. just Scan and Opt Torsion Selection Viable? (Wed Oct 18 2023 - 06:13:50 CDT)
- Re: Viewing Van der Waals bonds of a protein ligand in complex inquiry (Mon Sep 11 2023 - 10:06:31 CDT)
- Has anyone successfully executed ORCA instead of Gaussian for ffTK? (Sun Jun 25 2023 - 06:28:49 CDT)
- Re: fftk-Tutorial Writing psf and pdb files from a CGenFF .str File Inquiry (Fri Apr 07 2023 - 11:35:41 CDT)
- Re: fftk-Tutorial Writing psf and pdb files from a CGenFF .str File Inquiry (Fri Apr 07 2023 - 07:24:56 CDT)
- Re: Re: ffTK Opt Torsions Refine Section EDIT ENTRY SECTION PROBLEM (Tue Mar 28 2023 - 19:33:46 CDT)
- Re: Re: ffTK Opt Torsions Refine Section EDIT ENTRY SECTION PROBLEM (Tue Mar 28 2023 - 19:30:06 CDT)
- Re: Re: ffTK Opt Torsions Refine Section EDIT ENTRY SECTION PROBLEM (Tue Mar 28 2023 - 18:28:01 CDT)
- Re: Re: No ffTK .gau Extension in Determine File Type in VMD for Visualization Problem? (Thu Mar 23 2023 - 13:45:28 CDT)
- Joel Subach (via Dropbox)
- Joey Gehring
- Joey Vella
- Johannes Haataja
- Johannes Mllegger
- Johannes Schauer
- Johannes von Langen
- John
- John Brown
- John C. H. Chao
- John Duff
- John E. Kerrigan
- John Eargle
- JOHN FLANAGAN
- John Grime
- John H
- John Hodrien
- John Hondroulis
- John Jumper
- John Keller
- John Kerrigan
- John M. Kolinski
- John M. Robinson
- John Michael Alex Grime
- John R. Kitchin
- John Robert Kitchin
- John Robinson
- John Stone
- Re: CUDA error: an illegal memory access was encountered, CUDAQuickSurf.cu (Mon Apr 17 2023 - 11:13:20 CDT)
- Re: CUDA error: an illegal memory access was encountered, CUDAQuickSurf.cu (Mon Apr 10 2023 - 00:58:11 CDT)
- Re: can't build VMD on MacOs Ventura: use of undeclared identifier 'msms' (Tue Mar 07 2023 - 12:55:57 CST)
- Re: Re: Re: Fwd: Problem building vmd with ospray - OSPRayRenderer.h error: ???OSPModel??? does not name a typ (Fri Feb 24 2023 - 20:03:54 CST)
- Re: Running VMD 1.9.4alpha on newer GPUs that require CUDA 11+ and OptiX 7+ (Tue Jan 31 2023 - 22:30:35 CST)
- Re: NewCartoon or NewRibbons Secondary Structure methods don't work with latest updated Mesa 22.2.3 (Thu Dec 29 2022 - 11:17:52 CST)
- Re: How to choose solid color in clipping plane render with POV-Ray (Tue Aug 30 2022 - 14:45:43 CDT)
- Re: How to choose solid color in clipping plane render with POV-Ray (Tue Aug 30 2022 - 11:42:31 CDT)
- Re: Unable to useTachyon-Optix renderer when VMD is installed in Windows Subsystem for Linux (WSL) (Wed Jun 15 2022 - 00:01:03 CDT)
- Re: Why the restype color of Gly residue in protein is green (polar)? (Tue May 24 2022 - 08:40:01 CDT)
- Re: VMD Visualizers and AutoPSF unusable on Mac BigSur and VMD1.9.4a55 (Fri May 06 2022 - 01:23:03 CDT)
- Re: Parallel rendering example from tutorial, "VMD parallel commands" (Fri May 06 2022 - 00:36:13 CDT)
- Re: Parallel rendering example from tutorial, "VMD parallel commands" (Wed May 04 2022 - 23:16:21 CDT)
- Re: Parallel rendering example from tutorial, "VMD parallel commands" (Wed May 04 2022 - 15:11:39 CDT)
- Re: VMD 1.9.4 crashes after running the "Merge Structures" plugin (with psfgen 2.0) (Wed Apr 06 2022 - 09:48:56 CDT)
- Re: VMD 1.9.4 crashes after running the "Merge Structures" plugin (with psfgen 2.0) (Mon Apr 04 2022 - 11:30:35 CDT)
- Re: VMD 1.9.4 crashes after running the "Merge Structures" plugin (with psfgen 2.0) (Mon Apr 04 2022 - 10:20:26 CDT)
- Re: VMD 1.9.4 crashes after running the "Merge Structures" plugin (with psfgen 2.0) (Mon Apr 04 2022 - 10:11:51 CDT)
- Re: Problem w/ DCD Title Block When Saving - Using 'Animate Write' vs Saving Via GUI (Tue Mar 08 2022 - 12:16:36 CST)
- Re: Issue running vmd and tk commands on my computer through script (Thu Feb 03 2022 - 23:17:21 CST)
- Re: How to write a netcdf file in vmd from already loaded netcdf/dcd trajectory (Sat Dec 25 2021 - 00:27:21 CST)
- Re: Early access to VMD builds with full-time interactive ray tracing display mode (Tachyon RTX RTRT) (Tue Oct 19 2021 - 20:51:07 CDT)
- Early access to VMD builds with full-time interactive ray tracing display mode (Tachyon RTX RTRT) (Tue Oct 19 2021 - 13:27:56 CDT)
- Re: partially loading all dcd files using animatedcds X_ChangeProperty: BadValue (Mon Oct 18 2021 - 12:13:47 CDT)
- Re: How can I make VMD use the correct graphics card in a Remote Desktop session? (Mon Oct 18 2021 - 11:46:18 CDT)
- Re: cannot visualize GROMACS trajectories in VMD 1.9.4 on MacOS Big Sur (Tue Mar 16 2021 - 11:48:14 CDT)
- Re: VMD Compilation with LEPTON & C++11 to support COLVARS "customFunction" WORKS now --- FLTK issue now (Sat Mar 06 2021 - 16:30:09 CST)
- Re: VMD Compilation with LEPTON & C++11 to support COLVARS "customFunction" WORKS now --- FLTK issue now (Sat Mar 06 2021 - 15:26:51 CST)
- Re: VMD Compilation with LEPTON & C++11 to support COLVARS "customFunction" WORKS now --- FLTK issue now (Sat Mar 06 2021 - 12:37:13 CST)
- Re: Redundant entries in force field parameters generated by paratool plugin in VMD (Thu Mar 04 2021 - 09:39:23 CST)
- Re: Redundant entries in force field parameters generated by paratool plugin in VMD (Wed Mar 03 2021 - 21:30:41 CST)
- Re: Problem in DISPLAY of VMD from remote server in local Mac Machine (Tue Feb 23 2021 - 13:42:35 CST)
- Re: Tachyon sometimes suddenly freezes up when rendering epotential images (Mon Jan 25 2021 - 23:59:30 CST)
- Re: OpenGL window not rendering over ssh but works when connecting from other computers and works fine locally (Sat Jan 23 2021 - 14:07:28 CST)
- Re: /usr/local/lib/vmd/vmd_LINUXAMD64: error while loading shared libraries: libOpenGL.so.0: (Mon Jan 11 2021 - 16:42:59 CST)
- Re: Problem with rendering modified bond label position with Tachyon (Thu Dec 31 2020 - 13:01:59 CST)
- Re: VMD 1.9.4a50 test versions for MacOS Big Sur -- both x86 and ARM64 (M1) (Thu Dec 31 2020 - 12:00:07 CST)
- Re: VMD 1.9.4a50 test versions for MacOS Big Sur -- both x86 and ARM64 (M1) (Mon Dec 14 2020 - 09:56:07 CST)
- VMD 1.9.4a50 test versions for MacOS Big Sur -- both x86 and ARM64 (M1) (Mon Dec 14 2020 - 01:55:40 CST)
- Re: ProDy issue with QMonly.psf/dcd from QMMM NAMD-ORCA simulations (Sat Dec 12 2020 - 11:52:57 CST)
- Re: TCL script for creating multiple representations on the same molecule (Tue Oct 06 2020 - 11:12:27 CDT)
- Re: Configuring Tkcon in VMD for Catalina to access history with up arrow (Fri Jul 24 2020 - 14:40:45 CDT)
- Re: Configuring Tkcon in VMD for Catalina to access history with up arrow (Fri Jul 24 2020 - 13:36:24 CDT)
- Re: Molefacture does not write bond angles and dihedral angles info in the psf file (Thu Jul 23 2020 - 16:47:56 CDT)
- Re: VRAM memory piling up OPTIX 1.9.4a42 rendering consecutive frames (Tue Jun 16 2020 - 12:05:48 CDT)
- Re: Failed to create Optix rendering context ERROR: Invalid value (OptiXRenderer.C:1214 (Thu Jun 11 2020 - 21:56:17 CDT)
- Re: VRAM memory piling up OPTIX 1.9.4a42 rendering consecutive frames (Thu Jun 11 2020 - 15:59:34 CDT)
- Re: VRAM memory piling up OPTIX 1.9.4a42 rendering consecutive frames (Wed Jun 10 2020 - 11:16:17 CDT)
- Re: VRAM memory piling up OPTIX 1.9.4a42 rendering consecutive frames (Wed Jun 10 2020 - 11:11:36 CDT)
- Re: VRAM memory piling up OPTIX 1.9.4a42 rendering consecutive frames (Wed Jun 10 2020 - 10:05:54 CDT)
- Re: Failed to create Optix rendering context ERROR: Invalid value (OptiXRenderer.C:1214 (Fri May 29 2020 - 16:46:33 CDT)
- Re: Failed to create Optix rendering context ERROR: Invalid value (OptiXRenderer.C:1214 (Wed May 27 2020 - 16:26:16 CDT)
- Re: Failed to create Optix rendering context ERROR: Invalid value (OptiXRenderer.C:1214 (Mon May 25 2020 - 23:16:04 CDT)
- Re: How to download high-quality images from MEMBPLUGIN -> "Membrane thickness map" (Sat May 23 2020 - 02:23:03 CDT)
- Re: Early VMD 1.9.4 alpha builds for MacOS X Catalina (e.g., 10.15.4) (Tue Apr 28 2020 - 13:25:08 CDT)
- Re: Problem with Surf representation in the latest version macOS Catalina (Tue Apr 28 2020 - 11:42:13 CDT)
- Re: Early VMD 1.9.4 alpha builds for MacOS X Catalina (e.g., 10.15.4) (Tue Apr 28 2020 - 11:29:38 CDT)
- Re: Problem with Surf representation in the latest version macOS Catalina (Tue Apr 28 2020 - 11:18:49 CDT)
- Re: Problem with Surf representation in the latest version macOS Catalina (Mon Apr 27 2020 - 16:04:29 CDT)
- Re: Early VMD 1.9.4 alpha builds for MacOS X Catalina (e.g., 10.15.4) (Sun Apr 26 2020 - 14:33:34 CDT)
- Re: Early VMD 1.9.4 alpha builds for MacOS X Catalina (e.g., 10.15.4) (Sun Apr 26 2020 - 14:29:43 CDT)
- Re: Early VMD 1.9.4 alpha builds for MacOS X Catalina (e.g., 10.15.4) (Sat Apr 25 2020 - 21:55:20 CDT)
- Re: Early VMD 1.9.4 alpha builds for MacOS X Catalina (e.g., 10.15.4) (Sat Apr 25 2020 - 22:07:53 CDT)
- Re: Early VMD 1.9.4 alpha builds for MacOS X Catalina (e.g., 10.15.4) (Fri Apr 24 2020 - 00:46:13 CDT)
- Re: Early VMD 1.9.4 alpha builds for MacOS X Catalina (e.g., 10.15.4) (Fri Apr 17 2020 - 22:23:30 CDT)
- Re: Early VMD 1.9.4 alpha builds for MacOS X Catalina (e.g., 10.15.4) (Fri Apr 17 2020 - 16:04:27 CDT)
- Re: Segfault in VMD 1.9.4a38 in DrawMolItem::draw_volume_isosurface_points (Fri Apr 03 2020 - 11:11:56 CDT)
- Re: Segfault in VMD 1.9.4a38 in DrawMolItem::draw_volume_isosurface_points (Fri Apr 03 2020 - 09:24:28 CDT)
- Re: New VMD 1.9.4 test versions posted with many new updates/features... (Fri Dec 13 2019 - 00:09:20 CST)
- FLTK 1.4.0 and high-DPI screens for VMD Re: Re: VMD 1.9.4a38 build for macOS Catalina (Mon Dec 09 2019 - 08:52:07 CST)
- Re: Loading large trajectories using multiple threads/direct calls? (Thu Dec 05 2019 - 12:41:06 CST)
- Re: Loading large trajectories using multiple threads/direct calls? (Thu Dec 05 2019 - 10:07:50 CST)
- Re: visualising the bonds which indicated by "connect" order in pdb files (Wed Nov 13 2019 - 00:38:47 CST)
- Re: Re: namd-l: Is there someway to render protein picture without background color? (Thu Sep 26 2019 - 13:33:30 CDT)
- Re: Re: namd-l: Is there someway to render protein picture without background color? (Thu Sep 19 2019 - 10:13:52 CDT)
- Re: Re: namd-l: Is there someway to render protein picture without background color? (Tue Sep 17 2019 - 16:11:48 CDT)
- Re: New VMD 1.9.4 test versions posted with many new updates/features... (Tue Jul 23 2019 - 23:28:39 CDT)
- Re: New VMD 1.9.4 test versions posted with many new updates/features... (Wed Jul 17 2019 - 15:43:42 CDT)
- Re: New VMD 1.9.4 test versions posted with many new updates/features... (Tue Jul 16 2019 - 17:28:15 CDT)
- New VMD 1.9.4 test versions posted with many new updates/features... (Wed Jul 10 2019 - 15:29:12 CDT)
- Re: Sub: making a trajectory with frames having different number of water molecules. (Mon Jul 08 2019 - 00:33:04 CDT)
- Re: RTX-accelerated VMD 1.9.4 test build for 64-bit Linux posted... (Mon Apr 29 2019 - 20:50:31 CDT)
- QuickSurf error Re: RTX-accelerated VMD 1.9.4 test build for 64-bit Linux posted... (Mon Apr 29 2019 - 21:09:42 CDT)
- Re: Rasterized default display rendering vs ray-tracing (interactive) (Wed Apr 17 2019 - 08:41:53 CDT)
- Re: calculate the percentage of beta-sheet and alpha helix with time evolution (Thu Apr 04 2019 - 23:55:04 CDT)
- Re: RTX-accelerated VMD 1.9.4 test build for 64-bit Linux posted... (Sat Mar 16 2019 - 01:11:39 CDT)
- Updated RTX-accelerated VMD 1.9.4 test build for 64-bit Linux posted... (Fri Mar 15 2019 - 16:31:14 CDT)
- Re: RTX-accelerated VMD 1.9.4 test build for 64-bit Linux posted... (Mon Mar 11 2019 - 15:35:39 CDT)
- Re: RTX-accelerated VMD 1.9.4 test build for 64-bit Linux posted... (Tue Mar 05 2019 - 22:00:23 CST)
- Re: RTX-accelerated VMD 1.9.4 test build for 64-bit Linux posted... (Tue Mar 05 2019 - 10:17:50 CST)
- Re: Pause script, make display interactive, then resume script after user input (Wed Jan 23 2019 - 23:45:27 CST)
- Re: Pause script, make display interactive, then resume script after user input (Fri Jan 18 2019 - 16:44:29 CST)
- Re: Ambient/direct light missing after adding Glow lights to a tachyon scene with glow_lights.tcl (Fri Oct 19 2018 - 08:37:46 CDT)
- Re: Is occulus rift plug-and-play with VMD yet? If so, what are the capabilities? (Thu Mar 22 2018 - 11:31:04 CDT)
- Re: Changing isosurface wireframe thickness when rendering with TachyonL (Wed Mar 21 2018 - 10:36:54 CDT)
- Re: Building plugins with _USE_ZLIB (how to activate preprocessor macro) (Tue Mar 13 2018 - 17:10:13 CDT)
- Re: Building plugins with _USE_ZLIB (how to activate preprocessor macro) (Tue Mar 13 2018 - 16:48:50 CDT)
- Re: Building plugins with _USE_ZLIB (how to activate preprocessor macro) (Tue Mar 13 2018 - 14:29:20 CDT)
- Re: VMD TCL Script to save last frame of a trajectory using bash+tcl scripts (Tue Feb 20 2018 - 10:49:00 CST)
- Re: Is occulus rift plug-and-play with VMD yet? If so, what are the capabilities? (Fri Oct 13 2017 - 15:05:33 CDT)
- Re: VMD from remote workstation (followup: crash with Intel drivers) (Tue Oct 10 2017 - 10:10:58 CDT)
- Re: Electrostatic interaction calculations using the NAMD Energy Plugin and PME (Wed Sep 13 2017 - 11:51:55 CDT)
- Re: How to get 3D figure of solvent accessible surface area from APBS output (Thu Aug 31 2017 - 17:18:19 CDT)
- Re: Is occulus rift plug-and-play with VMD yet? If so, what are the capabilities? (Thu Aug 24 2017 - 15:37:18 CDT)
- Re: VMD 1.9.3 crashes during loading GROMACS trr trajectory in linux. (Wed May 31 2017 - 16:33:16 CDT)
- Re: Accessing tachyon optix from commandline and dat file generation (Tue Apr 04 2017 - 15:30:20 CDT)
- Re: Accessing tachyon optix from commandline and dat file generation (Mon Apr 03 2017 - 09:45:35 CDT)
- Re: VMD 1.9.3 crashes during loading GROMACS trr trajectory in linux. (Thu Mar 02 2017 - 14:25:30 CST)
- Re: VMD 1.9.3 crashes during loading GROMACS trr trajectory in linux. (Tue Feb 28 2017 - 12:57:57 CST)
- Re: Fwd: Termination when using QuickSurf, libGL no version info, and CUDA Error in start up (Tue Feb 28 2017 - 12:53:46 CST)
- Re: Re: Re: vmd cannot display part of the protein in gromacs gro/trr file format (Mon Feb 13 2017 - 14:25:15 CST)
- Re: Re: vmd cannot display part of the protein in gromacs gro/trr file format (Wed Feb 08 2017 - 15:38:45 CST)
- Re: vmd cannot display part of the protein in gromacs gro/trr file format (Fri Feb 03 2017 - 10:31:45 CST)
- Re: Feature request: "Apply to all molecules" option in graphical representation window (Wed Jan 18 2017 - 17:17:50 CST)
- Re: isosurface stays gray after using "surface_color" command and "rebuild" (Wed Jan 11 2017 - 08:07:56 CST)
- Re: rlwrap: Command not found. /usr/local/lib/vmd/vmd_LINUX: Command not found. (Fri Dec 09 2016 - 13:46:00 CST)
- Re: Re: rlwrap: Command not found. /usr/local/lib/vmd/vmd_LINUX: Command not found. (Fri Dec 09 2016 - 10:10:53 CST)
- Re: Distribute evenly n-molecules at m-angstroem from protein surface (Sat Dec 03 2016 - 23:38:11 CST)
- Re: Rendering with Tachyon GPU enabled (TachyonLOptiXInternal) with options (Sun Nov 27 2016 - 23:58:33 CST)
- Re: Rotate molecular system without rotating objects added with the graphics command (Fri Nov 04 2016 - 09:53:00 CDT)
- Re: selection atoms depending on bonding, selection of 'new' molecules (Fri Oct 14 2016 - 10:05:05 CDT)
- Re: selection atoms depending on bonding, selection of 'new' molecules (Fri Oct 14 2016 - 09:41:12 CDT)
- Re: chain identifier change in the pdb files generated by the "solvate" and "Add Ions" plugin (Mon Oct 03 2016 - 16:10:19 CDT)
- Apply for ACS Comp travel awards for Spring 2017 meeting in San Francisco (Wed Sep 28 2016 - 11:16:51 CDT)
- Re: How to make the script that shows simulation time on a movie work (Thu May 26 2016 - 11:19:50 CDT)
- Re: Rendering high quality obj, x3d and other files for use in other 3D representation systems (Sat Apr 02 2016 - 23:04:09 CDT)
- Re: Rendering high quality obj, x3d and other files for use in other 3D representation systems (Sat Apr 02 2016 - 22:44:07 CDT)
- Re: Rendering high quality obj, x3d and other files for use in other 3D representation systems (Sat Apr 02 2016 - 21:20:57 CDT)
- Re: Trouble launching VMD 1.9.2 from the dock in Mac OS X el capitan (Fri Apr 01 2016 - 00:46:01 CDT)
- Re: Unable to visualize my polymer chains generated using RIS theory using VMD properly (Wed Mar 16 2016 - 11:25:51 CDT)
- Re: Possible memory leak with adding and deleting molecules frequently (Tue Feb 23 2016 - 14:45:50 CST)
- Re: Feature request: Change printf( to fprintf(stderr, in molfile plugins (Thu Jan 28 2016 - 16:11:55 CST)
- Re: Re: -fpascal-strings flag when compiling with TDCONNEXION option (Wed Jan 13 2016 - 13:29:06 CST)
- Re: question about reading more volumes via atomselect or removing of them (Wed Jan 13 2016 - 13:38:27 CST)
- Re: Possible memory leak with adding and deleting molecules frequently (Wed Dec 02 2015 - 15:52:53 CST)
- Re: Making high quality pictures: How to increase the number of samples? (Sun Nov 01 2015 - 22:22:16 CST)
- Re: RE: Draw cylinder with two different diameters for the endpoints (cone) (Wed Oct 07 2015 - 16:38:27 CDT)
- Re: Segmentation fault error only when executing command within script (Fri Sep 25 2015 - 15:04:34 CDT)
- Re: Implicit Ligand Sampling: How to get energy along a reaction coordinate? (Wed Sep 23 2015 - 14:33:09 CDT)
- Re: embedding proteins in membrane: child killed: segmentation violation (Fri Aug 28 2015 - 01:33:32 CDT)
- Re: Choosing an appropriate isovalue for comparing different systems (Tue Jul 14 2015 - 10:14:12 CDT)
- Re: Running 64-bit Linux VMD in VMWare VM on Windows 8.1 64-bit Host Machine (Sat May 16 2015 - 13:51:48 CDT)
- Re: Is there currently support for loading large PDBx or PDBML files (e.g. 4YBB)? (Wed May 13 2015 - 12:06:36 CDT)
- Re: Residues within a specified distance across all trajectories time steps (Mon Apr 06 2015 - 10:59:53 CDT)
- Re: ??startup.command?? can??t be opened because CoreServicesUIAgent is not allowed to open documents in Terminal. (Mon Mar 30 2015 - 17:08:23 CDT)
- Re: Feature request: read environment to set FreeVR lib, include paths (Fri Feb 13 2015 - 08:58:05 CST)
- Re: Problem with VMD 1.9.1 and OS X 10.10 (OpenGL display freezing on reading PDB coordinates) (Tue Jan 27 2015 - 12:36:31 CST)
- Re: AW: AW: namd-l: FATAL ERROR: seek failed while writing DCD file: No such file or directory (Fri Dec 19 2014 - 12:10:47 CST)
- Re: Using the chirality and cispeptide plugins with "vmd -dispdev text" (Fri Dec 12 2014 - 20:33:04 CST)
- Re: Any interest in VMD supporting mirror reflections w/ ray tracing? (Fri Nov 28 2014 - 17:30:44 CST)
- Re: Re: Need testers: VMD 1.9.2 w/ interactive GPU ray tracing w/ AO, depth of field, etc. (Wed Nov 26 2014 - 13:42:21 CST)
- Re: Need testers: VMD 1.9.2 w/ interactive GPU ray tracing w/ AO, depth of field, etc. (Thu Nov 13 2014 - 00:21:33 CST)
- Re: Problem with VMD 1.9.1 and OS X 10.10 (OpenGL display freezing on reading PDB coordinates) (Fri Oct 31 2014 - 14:51:38 CDT)
- Re: Need testers: VMD 1.9.2 w/ interactive GPU ray tracing w/ AO, depth of field, etc. (Fri Oct 31 2014 - 11:31:36 CDT)
- Re: Problem with VMD 1.9.1 and OS X 10.10 (OpenGL display freezing on reading PDB coordinates) (Fri Oct 31 2014 - 11:22:29 CDT)
- Need testers: VMD 1.9.2 w/ interactive GPU ray tracing w/ AO, depth of field, etc. (Thu Oct 30 2014 - 11:33:12 CDT)
- Re: Creating multiple views from same trajectory file for movie generation (Wed Oct 01 2014 - 07:43:22 CDT)
- Re: "OpenGL Display" and "VMD Main" windows; size and location on launch (Sun Sep 28 2014 - 15:16:37 CDT)
- Re: Solvate Plugin: Why "Rotate to minimize volume" along 2 instead of 3 axes? (Mon Sep 22 2014 - 11:33:40 CDT)
- Re: Does the VMD Linux 64-bit version perform better than the Windows 32-bit when visualizing large molecules? (Tue Aug 05 2014 - 21:05:56 CDT)
- Re: any way to rotate and translate with mouse without changing modes? (Mon Jun 30 2014 - 22:31:31 CDT)
- Re: any way to rotate and translate with mouse without changing modes? (Wed Jun 25 2014 - 11:33:15 CDT)
- Re: Feature request: capturing tool location and steering forces in IMD trajectory (Mon May 19 2014 - 14:54:39 CDT)
- Re: Feature request: capturing tool location and steering forces in IMD trajectory (Fri May 16 2014 - 14:20:10 CDT)
- Re: Re: Mapping Gaussian electrostatic potential to electron density with cube files (Mon Mar 17 2014 - 19:37:54 CDT)
- Re: Fedora 20 x86_64 + ibus + sazanami fonts + GNOME => VMD 1.9.1 crashes (Sun Mar 09 2014 - 09:25:50 CDT)
- Re: Webinar on VMD's use of GPUs to accelerate MD visualization and analysis (Mon Feb 24 2014 - 08:57:40 CST)
- Webinar on VMD's use of GPUs to accelerate MD visualization and analysis (Mon Feb 17 2014 - 16:15:03 CST)
- Re: Speeding up the VDW drawing method and Tachyon rendering process (Tue Nov 26 2013 - 19:02:31 CST)
- Re: segmentation fault error when trying to add bonds to Si3N4 crystal in vmd (Fri Nov 22 2013 - 23:26:12 CST)
- Re: "measure symmetry" and SymmetryTools fail to find simple symmetry (Fri Nov 22 2013 - 14:43:21 CST)
- Re: Mapping Gaussian electrostatic potential to electron density with cube files (Fri Nov 22 2013 - 13:19:10 CST)
- Re: "measure symmetry" and SymmetryTools fail to find simple symmetry (Wed Nov 20 2013 - 19:27:21 CST)
- Re: segmentation fault error when trying to add bonds to Si3N4 crystal in vmd (Mon Nov 18 2013 - 12:15:49 CST)
- Re: Certain combinations of X-server and X-client do not allow VMD to start (Mon Sep 16 2013 - 23:56:11 CDT)
- Re: Quality of color scale bar when creating images for publication (Tue Aug 27 2013 - 11:36:54 CDT)
- Re: Re: VRPN driver for Novint Falcon haptic device available - Looking for Testers (Mon Aug 19 2013 - 11:52:52 CDT)
- Re: How can I easily show ball and stick residues across all molecules and representations? (Thu Jul 18 2013 - 21:43:02 CDT)
- Re: RE: secondary structure works on linux, it doesn't work on Mac in certain structures (Mon Jul 08 2013 - 15:16:20 CDT)
- Re: Slow display with nVidia GeForce 9400GT and 3xx drivers on Linux (Wed May 29 2013 - 13:36:10 CDT)
- Re: problem/NVIDIA 3D vision/VMD/Windows 7 Pro 64-bit/GeForce GTX680 (Wed May 22 2013 - 11:22:03 CDT)
- Re: problem/NVIDIA 3D vision/VMD/Windows 7 Pro 64-bit/GeForce GTX680 (Wed May 22 2013 - 10:47:15 CDT)
- Re: Computing the transformation_matrix for best fit alignment of structures (Thu Apr 18 2013 - 01:22:21 CDT)
- Re: Slow display with nVidia GeForce 9400GT and 3xx drivers on Linux (Mon Apr 15 2013 - 09:51:45 CDT)
- Re: Slow display with nVidia GeForce 9400GT and 3xx drivers on Linux (Thu Mar 21 2013 - 10:43:25 CDT)
- Re: Slow display with nVidia GeForce 9400GT and 3xx drivers on Linux (Fri Mar 15 2013 - 09:25:32 CDT)
- Re: Slow display with nVidia GeForce 9400GT and 3xx drivers on Linux (Fri Mar 08 2013 - 13:09:14 CST)
- Re: Slow display with nVidia GeForce 9400GT and 3xx drivers on Linux (Tue Mar 05 2013 - 15:27:41 CST)
- Re: VMD-1.9.1 and TC/TK-8.6 break analysis g(r) and IR Spectral Density Calculator (Thu Feb 28 2013 - 15:13:10 CST)
- Re: VMD-1.9.1 and TC/TK-8.6 break analysis g(r) and IR Spectral Density Calculator (Wed Feb 27 2013 - 17:54:18 CST)
- Re: Load a molecule in a function without output and slow Tcl gui console (Wed Feb 27 2013 - 16:05:25 CST)
- Re: Load a molecule in a function without output and slow Tcl gui console (Wed Feb 27 2013 - 10:34:02 CST)
- Re: Load a molecule in a function without output and slow Tcl gui console (Tue Feb 26 2013 - 16:16:53 CST)
- Re: VMD-1.9.1 and TC/TK-8.6 break analysis g(r) and IR Spectral Density Calculator (Tue Feb 26 2013 - 16:04:09 CST)
- Re: Head Tracking for Desktop VR Displays using the WiiRemote and VMD (Tue Feb 26 2013 - 15:25:03 CST)
- Re: Re: namd-l: Assigning Partial Charges to FE in Active Site Superoxide Dismutase. (Thu Jan 24 2013 - 10:54:14 CST)
- Re: Re: VMD 1.9.1 core dumps (CentOS-5 x86_64) nvidia drivers: 304.64/4x GTX 680 (Tue Dec 11 2012 - 08:59:37 CST)
- Re: Re: VMD 1.9.1 core dumps (CentOS-5 x86_64) nvidia drivers: 304.64/4x GTX 680 (Mon Dec 10 2012 - 11:40:11 CST)
- Re: VMD can't display new PDB secondary structure properly ( pyMol, jMol can). . (Mon Nov 19 2012 - 21:02:20 CST)
- Re: MD very slow on a 8400M GS laptop (but not on a GT230M one) after NVidia driver update to 304.64 or 310.14 (Mon Nov 19 2012 - 18:28:54 CST)
- Re: VMD can't display new PDB secondary structure properly (pyMol, jMol can) (Mon Nov 19 2012 - 18:18:10 CST)
- Re: MD very slow on a 8400M GS laptop (but not on a GT230M one) after NVidia driver update to 304.64 or 310.14 (Mon Nov 19 2012 - 11:25:48 CST)
- Re: MD very slow on a 8400M GS laptop (but not on a GT230M one) after NVidia driver update to 304.64 or 310.14 (Sun Nov 18 2012 - 22:25:27 CST)
- Re: how to extract a frame in a binary coordinate restart file format for NAMD ? (Fri Oct 26 2012 - 10:34:23 CDT)
- Re: regarding representations, resolution and length of trajectory movies (Tue Oct 02 2012 - 14:55:31 CDT)
- Re: Possible handle leak in 'measure gofr' VMD 1.9.1 Windows (no cuda) (Fri Sep 21 2012 - 16:53:06 CDT)
- Re: Possible handle leak in 'measure gofr' VMD 1.9.1 Windows (no cuda) (Sun Aug 26 2012 - 21:33:39 CDT)
- Re: main menu rests to top molecule after each double click in a list of molecules (Tue Aug 21 2012 - 10:22:05 CDT)
- Re: possible problem with graphics rep gui under with large numbers of molecules (Fri Jul 27 2012 - 12:50:45 CDT)
- Re: APBS plugin requires molecule renaming after drag and drop loading of .pqr file (Fri Jul 27 2012 - 11:34:13 CDT)
- Re: Quick Surf Representation Getting Cutoff when Rendering with Tachyon (Tue May 29 2012 - 16:08:16 CDT)
- Re: align electron density map onto simulated structure (with different center) (Tue Apr 17 2012 - 00:13:31 CDT)
- Re: Average angle between the lipid dipole vector and the bilayer normal. (Wed Apr 11 2012 - 14:06:52 CDT)
- Re: Is there any way to stop the display of bonds for bonded atoms on opposite sides of a periodic boundary without unwrapping? (Thu Mar 29 2012 - 14:44:28 CDT)
- Re: [request] Best practices for rendering frames and making movies (Wed Feb 22 2012 - 11:12:27 CST)
- Re: Create multiple tcl interpreter child instances within VMD to run several scripts at once (Thu Feb 16 2012 - 11:52:15 CST)
- Re: Create multiple tcl interpreter child instances within VMD to run several scripts at once (Thu Feb 16 2012 - 11:40:11 CST)
- Re: ERROR) Tcl startup error: Can't find a usable init.tcl in the following directories: (Wed Feb 15 2012 - 10:08:38 CST)
- Re: Yet another python question: how to run a python script from the vmd console ? (Wed Feb 01 2012 - 23:33:46 CST)
- Re: Re: CUDA driver for Mac OS X 10.7 on Late 2008 13 inch Macbook with NVIDA GeForce 9400M 256 MB ? (Wed Jan 25 2012 - 09:59:13 CST)
- Re: Re: CUDA driver for Mac OS X 10.7 on Late 2008 13 inch Macbook with NVIDA GeForce 9400M 256 MB ? (Thu Jan 19 2012 - 13:07:25 CST)
- Re: Re: CUDA driver for Mac OS X 10.7 on Late 2008 13 inch Macbook with NVIDA GeForce 9400M 256 MB ? (Fri Jan 13 2012 - 14:52:45 CST)
- Re: Re: CUDA driver for Mac OS X 10.7 on Late 2008 13 inch Macbook with NVIDA GeForce 9400M 256 MB ? (Thu Jan 12 2012 - 10:48:06 CST)
- Re: Re: CUDA driver for Mac OS X 10.7 on Late 2008 13 inch Macbook with NVIDA GeForce 9400M 256 MB ? (Thu Jan 05 2012 - 15:14:17 CST)
- Re: VMD never finishes reading vis. state file, stalls and hoggs CPU (Wed Nov 30 2011 - 09:50:16 CST)
- Re: Feedback wanted from Linux VMD users with ATI/AMD graphics chipsets (Fri Nov 11 2011 - 16:13:14 CST)
- Re: Feedback wanted from Linux VMD users with ATI/AMD graphics chipsets (Fri Nov 11 2011 - 12:42:32 CST)
- Re: Adding a three letter residue name to VMD's protein recognition (Fri Nov 11 2011 - 12:24:10 CST)
- Re: Feedback wanted from Linux VMD users with ATI/AMD graphics chipsets (Fri Nov 11 2011 - 10:19:21 CST)
- Re: Adding an atom to existing trajectory (to enable RDF from centre of mass of a selection) (Fri Nov 11 2011 - 10:06:58 CST)
- Feedback wanted from Linux VMD users with ATI/AMD graphics chipsets (Mon Oct 31 2011 - 10:12:15 CDT)
- Re: How to select whole residues when at least one atom is within a specific distance (Thu Oct 13 2011 - 14:32:26 CDT)
- Re: Showing and Calculating the amount of water molecules inside carbon nanotube (Fri Sep 16 2011 - 13:59:40 CDT)
- Re: How can I draw secondary structures if I only have the carbon alpha coordinates (Thu Aug 18 2011 - 12:36:30 CDT)
- Re: How can I draw secondary structures if I only have the carbon alpha coordinates (Thu Aug 18 2011 - 11:48:01 CDT)
- Re: how to draw different set of points for different frames in a trajectory my script does not work (Tue Jul 12 2011 - 13:19:29 CDT)
- Re: A patch for OFF import and a question about representation of surfaces (Tue Jul 12 2011 - 13:22:54 CDT)
- Re: qpt_conv command of Hole is interactive, how to automate it for multiple frames? (Tue Jul 12 2011 - 13:08:13 CDT)
- Re: Does this work with VMD: Nvidia 3DVision Glasses + SyncMaster 2233RZ + GTX 580 + Win7? (Sat Jul 09 2011 - 22:20:20 CDT)
- Re: VMD does not exit after running closest.tcl script in combination with bigdcd (Fri Jun 10 2011 - 09:27:05 CDT)
- Re: VMD does not exit after running closest.tcl script in combination with bigdcd (Thu Jun 09 2011 - 16:02:54 CDT)
- Re: how do I show contacts with XXX angstroms between a protein and a ligand? (Mon Jun 06 2011 - 13:45:23 CDT)
- Re: how do I show contacts with XXX angstroms between a protein and a ligand? (Mon Jun 06 2011 - 13:42:29 CDT)
- Re: trying to combine closewater.tcl with bigdcd.tcl error frame 3 out of range for molecule 0 (Wed May 25 2011 - 10:18:12 CDT)
- Re: trying to combine closewater.tcl with bigdcd.tcl error frame 3 out of range for molecule 0 (Tue May 24 2011 - 12:13:07 CDT)
- Re: Do psf generated by psfgen and psf produced by "$sel writepsf" function in VMD have different impact on MD simulation using NAMD? (Tue May 17 2011 - 10:09:55 CDT)
- Re: Linkage problem when compiling fortran bindings for VMD molfile plugins (Fri Mar 18 2011 - 11:25:20 CDT)
- Re: Linkage problem when compiling fortran bindings for VMD molfile plugins (Fri Mar 18 2011 - 10:13:20 CDT)
- Re: Linkage problem when compiling fortran bindings for VMD molfile plugins (Mon Mar 14 2011 - 16:22:58 CDT)
- [carlos.simmerling@gmail.com: Re: ACS award information, Oct 15 deadline] (Tue Aug 24 2010 - 09:48:02 CDT)
- Re: PQR parser failure in pqr plugin 0.5 and pqr plugin in latest alpha (Wed Aug 18 2010 - 15:30:39 CDT)
- Re: PQR parser failure in pqr plugin 0.5 and pqr plugin in latest alpha (Wed Aug 18 2010 - 13:38:40 CDT)
- Re: plugin : membrane builder : "integer value too large to represent" (Wed Aug 18 2010 - 13:07:13 CDT)
- Re: VMD questions about animating residue distance lines and contact maps (Fri Aug 13 2010 - 13:03:59 CDT)
- Re: VMD questions about animating residue distance lines and contact maps (Thu Aug 12 2010 - 16:43:46 CDT)
- Re: VMD failure of RMSD Traj Tool, time index on each rendered frame, and crash (Tue Jul 20 2010 - 11:04:44 CDT)
- Re: VMD failure of RMSD Traj Tool, time index on each rendered frame, and crash (Tue Jul 20 2010 - 10:39:53 CDT)
- Re: VMD Crashes on Windows Vista when trying to load more than 5000 steps (Mon Jul 19 2010 - 09:55:03 CDT)
- Re: Symmetry Tool Error (Draw): invalid command name "getargs" and expected integer but got "" (Wed Apr 28 2010 - 11:13:11 CDT)
- Re: Problems with licorice representation when rendering 3D PDF for Power Point (Fri Apr 23 2010 - 12:54:49 CDT)
- Re: Problems with licorice representation when rendering 3D PDF for Power Point (Thu Apr 22 2010 - 17:22:33 CDT)
- Re: mol urlload -- this doesn't seem to work in Windows (it does seem to work from Linux) (Fri Apr 16 2010 - 18:22:20 CDT)
- Re: mol urlload -- this doesn't seem to work in Windows (it does seem to work from Linux) (Fri Apr 16 2010 - 18:10:22 CDT)
- Re: mol urlload -- this doesn't seem to work in Windows (it does seem to work from Linux) (Fri Apr 16 2010 - 17:00:15 CDT)
- Re: RuntimeError: tk.h version (8.4) doesn't match libtk.a version (8.5) (Fri Apr 02 2010 - 00:26:18 CDT)
- Re: Can anyone help me get the coordinate of the cylinders in the cartoon representation? (Wed Mar 03 2010 - 10:56:00 CST)
- Re: Converting tracker coordinates to molecule coordinate for selection (Fri Feb 12 2010 - 11:32:37 CST)
- Re: Converting tracker coordinates to molecule coordinate for selection (Fri Feb 12 2010 - 00:26:09 CST)
- Re: bad text display in tk console (ubuntu 8.04 VMD 1.8.7 linux 32 bit) (Wed Jan 20 2010 - 14:12:07 CST)
- Re: bad text display in tk console (ubuntu 8.04 VMD 1.8.7 linux 32 bit) (Wed Jan 20 2010 - 12:37:38 CST)
- Re: bad text display in tk console (ubuntu 8.04 VMD 1.8.7 linux 32 bit) (Wed Jan 20 2010 - 12:24:16 CST)
- Re: bad text display in tk console (ubuntu 8.04 VMD 1.8.7 linux 32 bit) (Wed Jan 20 2010 - 10:24:45 CST)
- Re: bad text display in tk console (ubuntu 8.04 VMD 1.8.7 linux 32 bit) (Fri Jan 15 2010 - 12:01:17 CST)
- Re: slow visualization using molecular representations with VMD 1.8.7 on mac (Tue Jan 05 2010 - 08:59:04 CST)
- Re: Fwd: Fwd: Re: namd-l: Fwd: conf file for coarse grained simulation (Thu Dec 17 2009 - 13:33:34 CST)
- Re: Issues with flickering display using VMD 1.8.7 displaying over X11 to remote Mac (Wed Dec 16 2009 - 23:55:15 CST)
- Re: Issues with flickering display using VMD 1.8.7 displaying over X11 to remote Mac (Tue Dec 15 2009 - 15:20:01 CST)
- Re: vmd-1.8.7 building from source ->few plugins "package could not be loaded" (Wed Dec 09 2009 - 13:57:18 CST)
- Re: vmd-1.8.7 building from source ->few plugins "package could not be loaded" (Tue Dec 08 2009 - 14:44:06 CST)
- Re: Re: vmd 1.8.7 on Intel 64 bit: segmentation fault (however: 1.8.6 works!) (Tue Dec 08 2009 - 01:17:25 CST)
- Re: vmd-1.8.7 building from source ->few plugins "package could not be loaded" (Mon Dec 07 2009 - 14:43:51 CST)
- Re: aquire coordinates from the points of the solvent representation (Sat Nov 21 2009 - 01:01:15 CST)
- Re: Matrix: Warning: no convergence (0.00000000<390.26229858 after 1000 iterations). (Tue Nov 03 2009 - 16:18:43 CST)
- Re: Translating an atom along a specific direction and saving the pdb files (Tue Oct 20 2009 - 09:39:48 CDT)
- Re: Install VMD binary with CUDA, CUDA card detected but then error "no CUDA-capable device is available"--Solved (Sun Oct 11 2009 - 22:43:17 CDT)
- Web-based Flash/Quicktime 3-D VMD/Tachyon renderings of PDB structures (Wed Sep 23 2009 - 15:45:30 CDT)
- [carlos.simmerling@gmail.com: ACS awards application announcements] (Mon Sep 21 2009 - 12:54:04 CDT)
- Re: Install VMD binary with CUDA, CUDA card detected but then error "no CUDA-capable device is available" (Thu Sep 17 2009 - 21:34:36 CDT)
- Re: How to select a hetatom while get rid of N-term ACE in atomselect (Thu Sep 10 2009 - 10:56:08 CDT)
- Re: NAMD tutorial for Windows problem reading pgn file from vmd tkconsole (Fri Aug 21 2009 - 16:30:30 CDT)
- Re: can we control the number and distribution of solvate molecular (Wed Aug 12 2009 - 16:14:30 CDT)
- Re: Problem: volumetric data coloring fails on AIX5_64 with GXT6500 OpenGL renderer (Thu Jul 23 2009 - 12:49:24 CDT)
- Re: Problem: volumetric data coloring fails on AIX5_64 with GXT6500 OpenGL renderer (Mon Jul 20 2009 - 11:43:38 CDT)
- Re: Problem: volumetric data coloring fails on AIX5_64 with GXT6500 OpenGL renderer (Mon Jul 20 2009 - 11:29:20 CDT)
- Re: .xst file disagrees with pbctools/.dcd file - what are the limitations of pbctools? (Wed Jul 15 2009 - 14:32:57 CDT)
- Re: vmd 1.8.7 not spawn new console: feature,bug, or just different? (Thu Jun 25 2009 - 01:06:02 CDT)
- Re: "no CUDA accelerator devices available", Nvidia GeForce 9600 GT card (Wed Jun 24 2009 - 22:17:52 CDT)
- Re: trace the distance between center of mass of one certain residue and the other (Wed Jun 24 2009 - 15:34:05 CDT)
- Re: vmd 1.8.7 not spawn new console: feature,bug, or just different? (Wed Jun 24 2009 - 15:24:32 CDT)
- Re: VMD 1.8.7 beta5 probs with NVIDIA Quadro FX3450/4000 graphic card (Mon Jun 22 2009 - 09:29:11 CDT)
- Re: "Re: ABINIT plugin ready for testing: can read GEO and DEN files. (Thu Jun 18 2009 - 09:59:46 CDT)
- Re: Re: ABINIT plugin ready for testing: can read GEO and DEN files. (Wed Jun 17 2009 - 11:33:20 CDT)
- Re: Re: ABINIT plugin ready for testing: can read GEO and DEN files. (Tue Jun 16 2009 - 21:33:31 CDT)
- Re: using atomselect to write a set of atoms and not some residue whose residue numbers are in a list (Mon Jun 15 2009 - 10:38:18 CDT)
- Re: FW: Unable to render electrostatic potential cube files with most non-HF densities (Thu Jun 11 2009 - 08:54:59 CDT)
- Re: Accelerating your VMD 1.8.7 calculations with an NVIDIA Tesla GPU (Tue Jun 02 2009 - 10:25:36 CDT)
- Re: Plugin: molfile_plugin_t filename_extension; problem and bug... (Mon May 25 2009 - 23:28:34 CDT)
- Re: error messages "*** glibc detected *** free(): invalid pointer" (Wed Feb 18 2009 - 17:43:14 CST)
- Re: error messages "*** glibc detected *** free(): invalid pointer" (Wed Feb 18 2009 - 09:44:02 CST)
- Re: error messages "*** glibc detected *** free(): invalid pointer" (Mon Feb 16 2009 - 13:14:31 CST)
- Re: error messages "*** glibc detected *** free(): invalid pointer" (Mon Feb 16 2009 - 11:43:44 CST)
- Re: error messages "*** glibc detected *** free(): invalid pointer" (Mon Feb 16 2009 - 11:54:45 CST)
- Re: Problem when labeling atoms on machine with intel X4500HD integreted graphic card (Thu Feb 12 2009 - 15:46:21 CST)
- Re: "Sorry, this version VMD was compiled with Python support disabled" (Wed Feb 04 2009 - 16:31:09 CST)
- Re: Link between the electrostatic potential on the surface and the grid.dx generated by APBS (Mon Feb 02 2009 - 10:41:09 CST)
- Re: how to set color parameters differently for different molecules (Thu Jan 29 2009 - 15:41:18 CST)
- Re: Unable to run VMD in graphical mode/ ubuntu 8.10 / Open GL problem (Wed Jan 28 2009 - 09:25:52 CST)
- Re: [patch] potential CUDA acceleration - load-balancing on different CUDA devices (Wed Jan 28 2009 - 08:21:58 CST)
- Re: accessing bonds angles dihedrals etc lists after PSF file is read into VMD (Mon Jan 26 2009 - 15:42:17 CST)
- Re: accessing bonds angles dihedrals etc lists after PSF file is read into VMD (Thu Jan 22 2009 - 11:33:21 CST)
- Re: why atomselection "protein" can not choose all the protein atoms with different alternate locations? (Tue Oct 14 2008 - 11:43:43 CDT)
- Re: Vmd on MACOSX awkward msg at startup and error when running Ubq simulation (Mon Oct 06 2008 - 15:57:08 CDT)
- Re: trouble with running vmd after installation , machine gets hung (Sun Sep 21 2008 - 02:36:43 CDT)
- Re: Selecting atoms that have real SASA greater than 0, Not using "Surface" (Mon Jul 21 2008 - 10:22:51 CDT)
- Re: Error message in VMD console when I try to switch to Python mode. (Thu Jul 17 2008 - 16:50:42 CDT)
- Re: Error message in VMD console when I try to switch to Python mode. (Thu Jul 17 2008 - 09:21:29 CDT)
- Re: Error message in VMD console when I try to switch to Python mode. (Wed Jul 16 2008 - 14:19:51 CDT)
- Re: Error message in VMD console when I try to switch to Python mode. (Wed Jul 16 2008 - 13:28:55 CDT)
- Re: Discrepancy between colours when coloured by timestep and Tachyon rendered (Thu Jun 19 2008 - 13:54:40 CDT)
- Re: Discrepancy between colours when coloured by timestep and Tachyon rendered (Thu Jun 19 2008 - 13:25:49 CDT)
- Re: Discrepancy between colours when coloured by timestep and Tachyon rendered (Thu Jun 19 2008 - 13:02:04 CDT)
- Re: Discrepancy between colours when coloured by timestep and Tachyon rendered (Thu Jun 19 2008 - 13:05:52 CDT)
- Re: compilation with python 2.5 and file permissions from the CVS repository (Mon Apr 14 2008 - 10:26:18 CDT)
- Re: compilation with python 2.5 and file permissions from the CVS repository (Sun Apr 13 2008 - 15:29:57 CDT)
- Re: Selection "within x of something" is not updated throughout DCD trajectory? (Thu Mar 27 2008 - 14:04:35 CDT)
- Re: Re: unusual bond between the cysteine and arginine residue during the simulation (Fri Feb 29 2008 - 15:06:49 CST)
- Re: unusual bond between the cysteine and arginine residue during the simulation (Fri Feb 29 2008 - 13:58:08 CST)
- Re: preserving atom index or hexadecimal residue numbers after writepdb (Fri Jan 25 2008 - 00:12:56 CST)
- Re: X_ChangeProperty: BadValue (integer parameter out of range for operation) 0x40 (Tue Jan 08 2008 - 14:09:56 CST)
- Re: X_ChangeProperty: BadValue (integer parameter out of range for operation) 0x40 (Tue Jan 08 2008 - 14:10:41 CST)
- VMD-L post spam blocking, rescued messages from the last 30 days... (Fri Jan 04 2008 - 12:33:38 CST)
- Re: Trying to get VMD to run locally while logged into a remote machine (Mon Nov 26 2007 - 19:00:24 CST)
- Re: Trying to get VMD to run locally while logged into a remote machine (Tue Nov 20 2007 - 17:24:36 CST)
- Re: problem with colouring the surface with electroststic potential (Wed Nov 14 2007 - 11:19:27 CST)
- Re: problem with colouring the surface with electroststic potential (Tue Nov 13 2007 - 10:09:17 CST)
- Re: problem with protein RMSD calculation due to incomplete wrapping of both peptide chains (Thu Nov 01 2007 - 17:39:14 CDT)
- Re: how to display dcd file written with catdcd using an index file (Fri Oct 26 2007 - 15:50:55 CDT)
- Re: residue selection (water molecule within 5 ang. to protein in simulation) (Tue Oct 16 2007 - 10:57:29 CDT)
- Re: behavior of "mol addfile first/last" with non-integer frame numbers (Fri Sep 28 2007 - 13:37:49 CDT)
- Re: the console window is automatically closed without any error messages (Thu Sep 06 2007 - 12:36:44 CDT)
- Re: the console window is automatically closed without any error messages (Thu Sep 06 2007 - 10:52:49 CDT)
- Re: VMD crashes during the execution of a computational intensive TCL script (Mon Aug 20 2007 - 16:41:17 CDT)
- Re: Increasing use of RAM even if I put unset/delete for selections! Due to use of arrays? (Tue Aug 14 2007 - 12:14:38 CDT)
- Re: how to make user input during runtime of a tcl program using TkConsole? (Fri Aug 10 2007 - 10:25:55 CDT)
- Re: frame number input in tcl and direct mol graph display update (II) (Fri Jul 27 2007 - 12:40:35 CDT)
- Re: frame number input in tcl and direct mol graph display update (II) (Thu Jul 26 2007 - 16:25:21 CDT)
- Re: nonstandard solvate + cyclic peptides in explicit DMSO box + gofr (Thu Jul 26 2007 - 11:33:52 CDT)
- Re: Using VMD just to plot some coordinates from a mathematical/geometrical model (Tue Jun 26 2007 - 15:19:17 CDT)
- Re: Using VMD just to plot some coordinates from a mathematical/geometrical model (Fri Jun 22 2007 - 17:51:59 CDT)
- Re: Automatically shutting down VMD after NAMD terminates IMD connection (Sun May 20 2007 - 13:13:04 CDT)
- Re: How can i obtain a force and trajectory data of a PHANTOM in IMD simulation (Wed Apr 18 2007 - 16:51:47 CDT)
- Re: How can i obtain a force and trajectory data of a PHANTOM in IMD simulation (Wed Apr 18 2007 - 16:50:16 CDT)
- Re: RE: "which files to make a spatial grid?" => Bug for list command? (Tue Apr 17 2007 - 13:11:52 CDT)
- Re: 1.8.6 install for Windows OpenGL (Microsoft Windows 2000/XP/Vista (32-bit) using OpenGL) (Sun Apr 08 2007 - 11:26:33 CDT)
- Re: How do I overlap that specific nucletide between a protein and RNA? (Sun Apr 01 2007 - 23:07:46 CDT)
- Re: Movie Maker: How to specify use of trajectory in the movie script file (Mon Mar 12 2007 - 20:56:51 CDT)
- Re: Re: New Molecule (or Load Data) resets viewpoint of Display. Why? (Wed Mar 07 2007 - 16:41:04 CST)
- Re: VMD-1.8.5: GLSL & NVidia troubles + fixed previous Spaceball problem (Sat Feb 10 2007 - 23:58:18 CST)
- Re: Assigning Color Codes for stress/force in .xyz trajectory files (Fri Feb 09 2007 - 02:56:59 CST)
- Re: Re: namd-l: too large an area/lipid in POPE bilayers using membrane plugin (Mon Feb 05 2007 - 14:52:48 CST)
- Re: Error while running scripts: terminate called after throwing an instance of 'std::bad_alloc' (Mon Feb 05 2007 - 10:04:31 CST)
- Re: Error while running scripts: terminate called after throwing an instance of 'std::bad_alloc' (Sat Feb 03 2007 - 00:45:58 CST)
- Re: Error while running scripts: terminate called after throwing an instance of 'std::bad_alloc' (Fri Feb 02 2007 - 16:21:44 CST)
- Re: loading molecules with increasing number of backbone atoms in VMD (Wed Jan 17 2007 - 12:05:37 CST)
- Re: How to let vmd do secondary structure judgement for each frame and render it on play movie? (Sat Dec 16 2006 - 02:30:04 CST)
- Re: How to let vmd do secondary structure judgement for each frame and render it on play movie? (Fri Dec 15 2006 - 23:44:27 CST)
- Re: Precompiled 1.8.5 for Linux-IA64 installs with wrong flags in lib directory? (Thu Sep 21 2006 - 05:53:47 CDT)
- Re: VMD crashed due to: vmd_LINUXAMD64: indirect_vertex_array.c:659: emit_DrawArrays_old: Assertion `elements_per_request >= count' failed (Tue Jun 27 2006 - 17:15:03 CDT)
- Re: Is there any script to analyze radius gyration, center of mass of namd traj file dcd? (Thu Jun 22 2006 - 14:07:45 CDT)
- Re: VMD crashed due to: vmd_LINUXAMD64: indirect_vertex_array.c:659: emit_DrawArrays_old: Assertion `elements_per_request >= count' failed (Mon Jun 19 2006 - 14:43:06 CDT)
- Re: missing" Number of frames to render" in VMD window movie generator (Tue Jun 13 2006 - 11:51:15 CDT)
- Re: Global Command to load 200 pdb files, without using script files (Fri Jun 02 2006 - 11:52:30 CDT)
- Re: the crystal structure of gold: questions about making the psf and about visualization in VMD; (Thu May 25 2006 - 14:48:50 CDT)
- Re: Fw: (ʾ-ʼʼ)Re: vmd-lQ?= gamess plugin error when using symmetry operations (Thu May 25 2006 - 14:17:20 CDT)
- Re: Display the electrostatic character (delphimap) on the structure file (Wed May 24 2006 - 13:37:50 CDT)
- Re: the crystal structure of gold: questions about making the psf and about visualization in VMD; update (Tue May 23 2006 - 14:56:30 CDT)
- Re: How do I change details of a drawing style using the text interface? (Mon May 22 2006 - 17:52:31 CDT)
- Re: Display the electrostatic character (delphimap) on the structure file (Tue May 16 2006 - 13:14:20 CDT)
- Re: Display the electrostatic character (delphimap) on the structure file (Mon May 15 2006 - 12:29:27 CDT)
- Re: Display the electrostatic character (delphimap) on the structure file (Mon May 15 2006 - 12:15:11 CDT)
- Re: Display the electrostatic character (delphimap) on the structure file (Tue May 09 2006 - 09:25:09 CDT)
- Re: VMD-L: how to select water molecules between two residues in a trajectory. (Mon Apr 17 2006 - 11:33:19 CDT)
- Re: VMD-L: how to select water molecules between two residues in a trajectory. (Sat Apr 15 2006 - 17:17:16 CDT)
- Re: GLSL rendermode now OK on Linux with NVidia 8756 driver version (Tue Apr 11 2006 - 12:28:43 CDT)
- Re: Summing volumetric data within a sub-volume of a simulation cell (Thu Apr 06 2006 - 00:05:04 CDT)
- Re: Possible error in aligning/computing RMSD of 2 molecules with three or two atoms (Sun Mar 26 2006 - 23:58:57 CST)
- Re: Possible error in aligning/computing RMSD of 2 molecules with three or two atoms (Thu Mar 23 2006 - 15:55:38 CST)
- Re: Problem with differentiating atoms from different frames for dcd file (Wed Mar 22 2006 - 10:23:41 CST)
- Re: loading a trajectory using bigdcd and job launched on a PBS server (Thu Feb 23 2006 - 16:31:10 CST)
- VMD /w >2GB RAM on Windows XP, and Windows XP x64 64-bit version... (Wed Feb 22 2006 - 10:51:19 CST)
- Re: High CPU usage with vmd-1.8.4b6 (99.9 %CPU ...) while using the FPS indicator (Tue Jan 10 2006 - 09:54:52 CST)
- Re: Use VMD Graphics Primitives to Construct Stilized Cyclodextrins (Fri Nov 18 2005 - 11:06:36 CST)
- Re: Loading multiple molecules in one step / "Apply changes automatically" (Fri Oct 21 2005 - 10:32:20 CDT)
- Re: Loading multiple molecules in one step / "Apply changes automatically" (Fri Oct 21 2005 - 10:28:00 CDT)
- Re: TCL: centering molecule into middle of display after translation (Wed Oct 12 2005 - 17:54:13 CDT)
- Re: large output XYZ file > 2 Gio? (Re: [biosimgrid-team] Re: DCD to XYZ conversion) (Mon Oct 10 2005 - 14:53:09 CDT)
- Re: ???UNSURE??? Re: ???UNSURE??? Re: ???UNSURE??? Re: vmd crashes upon load of pdb (Fri Sep 23 2005 - 15:45:32 CDT)
- Re: Test version of VMD 1.8.4 for Linux/IA64 (SGI Prism, Altix, etc..) (Wed Jul 06 2005 - 13:02:03 CDT)
- Re: Test version of VMD 1.8.4 for Linux/IA64 (SGI Prism, Altix, etc..) (Tue Jul 05 2005 - 09:58:58 CDT)
- Re: Test version of VMD 1.8.4 for Linux/IA64 (SGI Prism, Altix, etc..) (Fri Jun 24 2005 - 11:21:56 CDT)
- Re: Test version of VMD 1.8.4 for Linux/IA64 (SGI Prism, Altix, etc..) (Wed Jun 22 2005 - 13:34:51 CDT)
- Re: Test version of VMD 1.8.4 for Linux/IA64 (SGI Prism, Altix, etc..) (Wed Jun 22 2005 - 10:58:38 CDT)
- Re: vmd installation with Mesa installed in a non-standard location (Thu Jun 02 2005 - 17:05:50 CDT)
- Re: an inconsistance between psf file and coor file after equilibration (Tue May 24 2005 - 11:12:22 CDT)
- Re: ied.py : tk.h version (8.3) doesn't match libtk.a version (8.4) (Wed May 18 2005 - 13:34:10 CDT)
- Re: console in vmd-1.8.3 amd64 is blank (like white text on white background) so I can't see any output messages (Thu Apr 21 2005 - 17:37:39 CDT)
- Re: console in vmd-1.8.3 amd64 is blank (like white text on white background) so I can't see any output messages (Thu Apr 21 2005 - 17:22:44 CDT)
- Re: vmd and Re: [PyMOL] pymol crashes with new [7167] nvidia driver (Tue Mar 29 2005 - 12:52:55 CST)
- Re: vmd and Re: [PyMOL] pymol crashes with new [7167] nvidia driver (Tue Mar 29 2005 - 11:31:14 CST)
- Re: vmd and Re: [PyMOL] pymol crashes with new [7167] nvidia driver (Mon Mar 28 2005 - 09:10:09 CST)
- Re: Can vmd select residues in radius of 3.5 to a specific residue? (Fri Mar 18 2005 - 08:16:15 CST)
- Re: Re: vmd not starting up on Fedora core 3 linux , InsightII to blame (Sun Mar 06 2005 - 21:46:07 CST)
- Re: Re: vmd not starting up on Fedora core 3 linux , InsightII to blame (Thu Mar 03 2005 - 15:17:02 CST)
- Re: Re: vmd not starting up on Fedora core 3 linux , InsightII to blame (Tue Mar 01 2005 - 17:29:13 CST)
- Re: installation of VIDEOMACH, how to point to the location of the files (Fri Feb 04 2005 - 14:31:15 CST)
- Re: installation of VIDEOMACH, how to point to the location of the files (Fri Feb 04 2005 - 09:57:09 CST)
- Re: Outputing Dihedral Indexes for key structures (backbone, alpha-helix, etc...) (Wed Feb 02 2005 - 10:08:07 CST)
- Re: script for mapping the electrostatic potential from APBS on surfaces (Wed Jan 26 2005 - 09:38:50 CST)
- Re: vmd not starting up on Fedora core 3 linux , nVidia quadro 980 XGL, nVidia 6629 driver (Tue Jan 11 2005 - 11:09:17 CST)
- Re: vmd not starting up on Fedora core 3 linux , nVidia quadro 980 XGL, nVidia 6629 driver (Mon Jan 10 2005 - 18:44:30 CST)
- Re: Re: vmd not starting up on Fedora core 3 linux , nVidia quadro 980 XGL, nVidia 6629 driver (Mon Jan 10 2005 - 18:05:54 CST)
- Re: vmd not starting up on Fedora core 3 linux , nVidia quadro 980 XGL, nVidia 6629 driver (Thu Jan 06 2005 - 17:28:14 CST)
- Re: nvidia quadro, linux_x86, and performance difference w/nvidia drivers 1.0.5336 vs anything newer or older on VMD 1.8.2 (Tue Jan 04 2005 - 18:22:52 CST)
- Re: nvidia quadro, linux_x86, and performance difference w/nvidia drivers 1.0.5336 vs anything newer or older on VMD 1.8.2 (Tue Jan 04 2005 - 17:45:07 CST)
- Re: nvidia quadro, linux_x86, and performance difference w/nvidia drivers 1.0.5336 vs anything newer or older on VMD 1.8.2 (Tue Jan 04 2005 - 16:26:29 CST)
- Re: VMD on Linux RH9 with ATI's fglrx-4.3.0-3.14.6 1280x1024@100Hz dumping core ... any helpful advice :>? (Tue Dec 21 2004 - 10:22:46 CST)
- Re: How to select water molecules within certain distance from a protein (Fri Aug 27 2004 - 15:27:01 CDT)
- Re: ATI fglrx 3.11 drivers for Radeon 8500 LE with linux 2.6 kernel, quad buffered stereo on sony G520??? (Wed Aug 25 2004 - 09:23:09 CDT)
- Re: molecular surface/multiple trajectory files/the speed in animation (Mon Aug 09 2004 - 23:22:56 CDT)
- Re: molecular surface/multiple trajectory files/the speed in animation (Mon Aug 09 2004 - 16:17:12 CDT)
- Re: Error in modifying and concatenating two pdb files into one [plz Help!] (Mon Aug 02 2004 - 09:59:02 CDT)
- Re: vmd 1.8.3a7 no longer works after installing NVIDIA dr iver x86_64 -1.0-6106 (Thu Jul 08 2004 - 17:21:15 CDT)
- Re: vmd 1.8.3a7 no longer works after installing NVIDIA driver x86_64 -1.0-6106 (Thu Jul 08 2004 - 16:41:06 CDT)
- Re: base plane not being filled in for terminal adenines in ribbons/new ribbons (Tue Jun 15 2004 - 14:38:30 CDT)
- Re: how to make whole biological unit / virus capsid from pdb BIOMT records (Sun Apr 18 2004 - 19:29:30 CDT)
- Re: Re: how to make unique chain pdb identifier of virus capsid 60 mer? (Sun Apr 18 2004 - 19:34:43 CDT)
- Re: how to make whole biological unit / virus capsid from pdb BIOMT records (Tue Apr 06 2004 - 09:59:56 CDT)
- Re: how to make whole biological unit / virus capsid from pdb BIOMT records (Mon Apr 05 2004 - 14:11:45 CDT)
- Re: .cshrc error prevents VMD working on OSX10.3.3??? or something else??? (Tue Mar 23 2004 - 10:54:22 CST)
- Re: I've tried latest vmd but still problems with mdcrd/crd/rst parser (Fri Feb 27 2004 - 14:07:28 CST)
- Test version of VMD 1.8.3 for Linux on AMD x86_64 (Athlon64 / Opteron) available... (Mon Feb 23 2004 - 14:14:33 CST)
- Re: Some pdb file contains many frames : How Can I retrieve all in a frame... (Mon Feb 16 2004 - 17:25:36 CST)
- Re: Some pdb file contains many frames : How Can I retrieve all in a frame... (Mon Feb 16 2004 - 11:50:58 CST)
- Re: Problems with graphics.color function under VMD's python interpreter (Fri Feb 13 2004 - 17:43:27 CST)
- Re: Some pdb file contains many frames : How Can I retrieve all in a frame... (Fri Feb 13 2004 - 11:31:34 CST)
- Re: any body else have VMD problems with Linux + ATI FireGL X1-256p + fglrx-glc22-4.3.0-3.7.0 (Wed Feb 11 2004 - 20:02:26 CST)
- Re: any body else have VMD problems with Linux + ATI FireGL X1-256p + fglrx-glc22-4.3.0-3.7.0 (Wed Feb 11 2004 - 18:33:51 CST)
- Re: Reading large traj file error or how to divide a large traj file into parts? (Wed Sep 10 2003 - 16:07:34 CDT)
- Re: Reading large traj file error or how to divide a large traj file into parts? (Wed Sep 10 2003 - 14:56:18 CDT)
- [tripp@fis.unam.mx: Re: Pls help me to render files with only traces of proteins!] (Thu Feb 06 2003 - 13:55:43 CST)
- [jrui@ci.uc.pt: Re: visualizing Delphi output (electrostatic potential)] (Thu Jan 23 2003 - 14:37:36 CST)
- [ARitger@nvidia.com: Re: problems with stereo display on NVIDIA Quadro4 750 XGL] (Tue Jan 14 2003 - 13:07:58 CST)
- Re: How to select the interacting atoms between two molecules in two different pdb files (Tue Sep 24 2002 - 15:30:25 CDT)
- John Young
- Jon
- Jon Savian
- Jonas Landsgesell
- Jonasz Sowada
- jonathan
- Jonathan Ashar
- JONATHAN BLACK
- Jonathan Booth
- Jonathan Gough
- jonathan KHAO
- Jonathan Phillips
- Joost Van Durme
- Jordi Bujons
- Jordi Cohen
- Jordi Faraudo
- Jorge Hernandez Fernandez
- Jorge Hernanez Fernandez
- Jorge Pikunic
- Jorgen Simonsen
- Jos Aerts
- Jose Dinto
- Jose Borreguero
- how to extract a frame in a binary coordinate restart file format for NAMD ? (Wed Oct 24 2012 - 14:13:37 CDT)
- JOSE MANUEL ROMO HERRERA
- Josef Scheiber
- Joseph Antoine Garate
- Joseph Baker
- Joseph Bylund
- Joseph E. Curtis
- Joseph Edward Curtis
- Joseph Fernandez
- Joseph Geraci
- Joseph Landman
- Joseph Norris
- Josh
- Josh Vermaas
- Re: looking for help to solve FATAL ERRORQ=BC=9A_Didn=27t_find_vdw_parameter_for_atom_type_C11?= (Thu Mar 07 2024 - 13:18:13 CST)
- Re: Running VMD 1.9.4alpha on newer GPUs that require CUDA 11+ and OptiX 7+ (Tue Jan 31 2023 - 08:58:37 CST)
- Re: How to calculate number of water molecules close to a nanostructure (Mon Oct 03 2022 - 09:03:37 CDT)
- Re: VMD 1.9.4 crashes after running the "Merge Structures" plugin (with psfgen 2.0) (Mon Apr 04 2022 - 11:15:30 CDT)
- Re: Discrepancy in value of dihedral angles of a sugar molecule by VMD tools (Thu Jul 22 2021 - 08:44:49 CDT)
- Re: Residue numbers changing after addition of simulation boxes below and above membrane cell (Mon Jun 21 2021 - 07:54:41 CDT)
- Re: How to make the trajectory file show the right bonds information in VMD (Thu Sep 24 2020 - 09:57:06 CDT)
- Re: Re: Error with initiation of additional production simulation using Qwikmd (Thu Jul 30 2020 - 16:33:10 CDT)
- Re: Problem with Surf representation in the latest version macOS Catalina (Mon Apr 27 2020 - 15:25:36 CDT)
- Re: MDFF chirality restrain error - measure imprp: empty atom index (Mon Apr 06 2020 - 12:04:07 CDT)
- Re: MDFF chirality restrain error - measure imprp: empty atom index (Wed Apr 01 2020 - 18:26:44 CDT)
- Re: namd-l: Pair interaction calculation is not supported in CUDA version (Sun Mar 15 2020 - 14:58:45 CDT)
- Re: solvate fails to set coordinates for the first few residues of the first chain? (Tue Apr 19 2016 - 17:09:00 CDT)
- Re: solvate fails to set coordinates for the first few residues of the first chain? (Tue Apr 19 2016 - 16:27:38 CDT)
- Re: Re: VMD Tricky selection of protein water bridge (2 bridge waters) (Mon Oct 05 2015 - 11:06:14 CDT)
- Re: Calculate torsional angle with big_dcd adding a boolean control for pyrimidines and purines selection (Wed Aug 26 2015 - 09:09:01 CDT)
- Re: Calculate torsional angle with big_dcd adding a boolean control for pyrimidines and purines selection (Wed Aug 26 2015 - 08:04:56 CDT)
- Re: Merging two structures with duplicate segment names using TCL/Tk Console (Tue Aug 11 2015 - 09:48:47 CDT)
- Re: Fwd: unwap/wrap failure in recomposing splitted system from periodic cells (Fri Jun 12 2015 - 11:20:26 CDT)
- Re: unwap/wrap failure in recomposing splitted system from periodic cells (Fri Jun 12 2015 - 09:47:24 CDT)
- Re: unwap/wrap failure in recomposing splitted system from periodic cells (Thu Jun 11 2015 - 14:31:39 CDT)
- Re: using the colvar module in VMD within a tcl loop through trajectory frames (Mon Apr 27 2015 - 10:58:33 CDT)
- Re: Residues within a specified distance across all trajectories time steps (Mon Apr 06 2015 - 15:49:34 CDT)
- Re: Fw: Colour coordinating atoms in a trajectory by Coordination Number (Mon Mar 30 2015 - 11:14:53 CDT)
- Re: Colour coordinating atoms in a trajectory by Coordination Number (Thu Mar 26 2015 - 12:12:29 CDT)
- Re: Script to impose coordinates from separate file onto equivalent selection of atoms (Thu Mar 26 2015 - 08:27:33 CDT)
- Re: How to write coordinates to a pdb without replacing existing entries (Mon Mar 09 2015 - 08:30:25 CDT)
- Re: Exposed area of a particular residue from dehydrated trajectory (Mon Jan 26 2015 - 11:30:46 CST)
- Re: show water around a residue for all the frames of the MD trajectory (Mon Jan 05 2015 - 10:49:39 CST)
- Re: FFTK most probably doesn't work with molecules containing new atom types (Sat Dec 13 2014 - 13:54:38 CST)
- Re: topotools question regarding ordering of bonds, angles, etc in output. (Fri Oct 03 2014 - 12:21:34 CDT)
- Re: namd-l: Problem with running namdenergy plugin from text interface (Mon Sep 22 2014 - 15:09:10 CDT)
- Re: Solvate Plugin: Why "Rotate to minimize volume" along 2 instead of 3 axes? (Mon Sep 22 2014 - 10:58:56 CDT)
- Re: Using more than 9 atom types for coloring method and visualizing half of a structure (Fri Aug 08 2014 - 15:23:20 CDT)
- Re: Vmd problem in display of surface in Md movie ( Gromacs trajectory) (Tue Aug 05 2014 - 10:59:23 CDT)
- Re: what is the center of rotation for the transformation matrix obtained by "measure fit" command? (Fri Jun 27 2014 - 10:15:58 CDT)
- Re: any way to rotate and translate with mouse without changing modes? (Wed Jun 25 2014 - 10:49:48 CDT)
- Re: convert AMBER format file to CHARMM format file or NAMD format file (Thu Apr 17 2014 - 10:27:43 CDT)
- Re: convert AMBER format file to CHARMM format file or NAMD format file (Wed Apr 16 2014 - 14:29:44 CDT)
- Re: FATAL ERROR: UNABLE TO FIND DIHEDRAL PARAMETERS FOR NH3 CT1 CT2A CT2 (ATOMS 1 5 7 10) (Thu Jan 23 2014 - 15:12:34 CST)
- Re: How can I easily show ball and stick residues across all molecules and representations? (Thu Jul 18 2013 - 19:48:04 CDT)
- Re: calculating distance between center of mass of two set of residues (Thu Jun 27 2013 - 14:29:11 CDT)
- Re: FATAL ERROR: UNKNOWN PARAMETER IN CHARMM PARAMETER FILE toppar_water_ions.str LINE=*set nat ?NATC* (Wed Apr 17 2013 - 17:57:01 CDT)
- Josh Ward
- Joshua A. Anderson
- Re: Re: CUDA driver for Mac OS X 10.7 on Late 2008 13 inch Macbook with NVIDA GeForce 9400M 256 MB ? (Wed Jan 25 2012 - 14:50:27 CST)
- Re: Re: CUDA driver for Mac OS X 10.7 on Late 2008 13 inch Macbook with NVIDA GeForce 9400M 256 MB ? (Thu Jan 19 2012 - 14:02:42 CST)
- Joshua A. Speidel
- Joshua Adelman
- Re: visualizing small molecule in a trajectory file .trr and .gro using VMD (Sat Jun 05 2010 - 08:16:16 CDT)
- Joshua Anderson
- Joshua D. Moore
- Re: Re: CUDA driver for Mac OS X 10.7 on Late 2008 13 inch Macbook with NVIDA GeForce 9400M 256 MB ? (Wed Jan 11 2012 - 19:09:50 CST)
- CUDA driver for Mac OS X 10.7 on Late 2008 13 inch Macbook with NVIDA GeForce 9400M 256 MB ? (Fri Dec 30 2011 - 19:07:05 CST)
- Joshua Dempster
- Joshua Engelman
- Joshua Moore
- Joshua Skootsky
- Joshua Speidel
- Josiah Zayner
- José Gómez
- José Villalaín
- jouko_at_berkeley.edu
- jouko_at_uchicago.edu
- Jovana Stelkic
- joy tehrani
- Joyce Tan
- Joyce Yang
- João M. Damas
- João Ribeiro
- Re: Atomselection with the position selected conditions inside the loop is not working properly (Thu Aug 16 2018 - 08:23:51 CDT)
- "Hands-on" Workshop on Enhanced Sampling and Free-Energy Calculation at Urbana, IL, September 10-14, 2018 (Mon Jul 30 2018 - 16:15:45 CDT)
- "'Hands-on" Workshop on Computational Biophysics at Pittsburgh, PA, May 21-25, 2018 (Fri Mar 16 2018 - 15:47:15 CDT)
- Re: "Hands-On" Workshop on QM/MM Simulations at Urbana, IL, April 5-7, 2018 (Tue Feb 27 2018 - 08:08:16 CST)
- "Hands-On" Workshop on QM/MM Simulations at Urbana, IL, April 5-7, 2018 (Wed Feb 07 2018 - 10:44:57 CST)
- "Hands-on" Workshop on Enhanced Sampling and Free-Energy Calculation at Urbana, IL, September 10-14, 2018 (Wed Feb 07 2018 - 10:46:51 CST)
- Re: Protein move out of the water box in a QwikMD setup MD simulation using explicit solvent condition (Thu Jul 27 2017 - 12:42:39 CDT)
- "Hands-on" Workshop on Enhanced Sampling and Free-Energy Calculation at Urbana, IL (Mon Jul 17 2017 - 14:45:43 CDT)
- "Hands-on" Workshop on Enhanced Sampling and Free-Energy Calculation at Urbana, IL (Tue Jun 27 2017 - 13:46:57 CDT)
- Re: Problems of generating the psf file with a protein that has a structural calcium (Thu Apr 06 2017 - 19:13:34 CDT)
- João Ribeiro KS
- Hands-On Workshop on Computational Biophysics: May 30 - June 2 in Pittsburgh, PA (Wed Mar 22 2017 - 10:15:41 CDT)
- Workshop on Computational Biophysics, Urbana, IL: Application Deadline March 10th (Sat Mar 04 2017 - 15:55:57 CST)
- Re: Hands-On Workshop on Computational Biophysics: April 17-21 in Urbana, IL (Fri Feb 24 2017 - 09:12:05 CST)
- Hands-On Workshop on Computational Biophysics: April 17-21 in Urbana, IL (Fri Feb 17 2017 - 16:57:08 CST)
- Re: What is the reasonable GPU usage when running simulation in VMD? (Thu Nov 17 2016 - 08:41:03 CST)
- Joo Ribeiro
- jrhau lung
- Re: Re: Error with initiation of additional production simulation using Qwikmd (Thu Jul 30 2020 - 18:44:45 CDT)
- Re: Error with initiation of additional production simulation using Qwikmd (Thu Jul 30 2020 - 06:48:11 CDT)
- Error with initiation of additional production simulation using Qwikmd (Mon Jul 27 2020 - 04:19:54 CDT)
- Protein move out of the water box in a QwikMD setup MD simulation using explicit solvent condition (Wed Jul 26 2017 - 20:37:32 CDT)
- Simulation the binding affinity between DNA or RNA with non-natural nucleic acid acid (Thu Feb 16 2017 - 02:59:41 CST)
- Re: What is the reasonable GPU usage when running simulation in VMD? (Thu Nov 17 2016 - 06:47:43 CST)
- Re: Error connecting to localhost on port 3000 and IMD connection ended unexpectedly; connection terminated. (Thu Oct 27 2016 - 06:19:56 CDT)
- Error connecting to localhost on port 3000 and IMD connection ended unexpectedly; connection terminated. (Thu Oct 27 2016 - 05:05:38 CDT)
- jrui_at_ci.uc.pt
- Re: Re: the script do not update the frame number for secondary structure analysis (Mon Feb 11 2008 - 04:55:39 CST)
- jsu_at_its.caltech.edu
- JT
- Juan Alfredo Freites
- Juan Antonio Raygoza Garay
- Juan de Dios Lopez Castro
- Juan Diaz
- Juan Felipe Ortiz
- juan jesus sanchez sanchez
- Juan R. Perilla
- Two postdoctoral positions available at the computational core of the Pittsburgh Center for HIV Protein Interactions External (Thu Jun 08 2023 - 08:37:45 CDT)
- juan roman
- juan.velasquez
- Jufang Shan
- Julia Doh
- Julia Steckner
- Julie Grouleff
- Julien Devemy
- Julio Cantu
- Jumper, John
- jun
- Jun Cheng
- Jun Zhao
- Jun-Chieh Wang
- JunJun Liu
- Jure Praznikar
- Justin
- Justin Gullingsrud
- Justin JEONG
- Justyna Jaroniec
- juzer stationwala
- jwc_at_itsa.ucsf.edu
- Jyh-Shyong Ho
- jz7_at_duke.edu
- János Szövérfi
- Jérôme Claverie
- Jérôme Hénin
- Re: How to fix the position of the lipid bilayer in the trajectories (Thu Mar 14 2019 - 12:37:58 CDT)
- Re: How to fix the position of the lipid bilayer in the trajectories (Thu Mar 14 2019 - 12:20:05 CDT)
- Re: How to fix the position of the lipid bilayer in the trajectories (Thu Mar 14 2019 - 07:52:07 CDT)
- Re: how do I keep graphics/representations in their designated frames? (they all show up in all frames) (Sun Apr 24 2016 - 04:34:57 CDT)
- Jrme Hnin
- K Jan
- K. Aurelia Ball
- Kabir Biswas
- Kaihsu Tai
- Kailee
- Kalavera_at_gmx.net
- kalyan chaitanya
- Kalyan Madanapalli
- Kalyanashis Jana
- Kamil Tamiola
- kamilt_at_ibmb.uni.wroc.pl
- Kamp, Marc vander
- Kamps, M.
- kanchi subbarao rao
- Kandarp Sojitra
- Kanishk Jain
- Kannan Ridings
- Kapil Amarnath
- Kara Di Giorgio
- karan uppal
- Karel Berka
- Karen Chan
- Kari Maher
- Karl Decker
- Karl Lundquist
- Karne, Sai Harish Babu
- Karol KASZUBA
- Karsten SUHRE
- Karteek K. Bejagam
- Karteek Kumar
- Kartheek
- karthigeyan karthigeyantp
- karthik kumar
- Kartik Tulsian
- Karunesh Arora
- Kasra Fattah
- Kassem Ghaddar
- Kateryna Miroshnychenko
- Katherine Parra
- Re: Error message in VMD console when I try to switch to Python mode. (Tue Jul 22 2008 - 11:07:56 CDT)
- Re: Error message in VMD console when I try to switch to Python mode. (Thu Jul 17 2008 - 09:30:22 CDT)
- Re: Error message in VMD console when I try to switch to Python mode. (Thu Jul 17 2008 - 09:13:14 CDT)
- Kathleen Barron
- Katya Lyakhova
- Kaur, Tarandeep
- kaushik lakkaraju
- kaustubh joshi
- Kazem Sepehrinia
- kazimieras tamoliunas
- Kei Sit
- Keister, Bradley
- Keith Battle
- Keith Oxenrider
- Keith Refson
- Kelly Leung
- Kelvin Chu
- Kelvin Luther
- Kemikal Kid Kolby
- Ken Sale
- Kendra Baker
- Kenley Barrett
- Kenneth Ayers
- Kenneth Smith
- Kenton Webster
- kerexen_at_gmail.com
- Keshab Thapa
- Kevin C Chan
- Kevin Chan
- Kevin DeMarco
- Kevin Knoops
- Kevin Lin
- Kevin Sanbonmatsu
- Kevin Smith
- Kevin Song
- Kevin Wittkowski
- Kevin Wu
- Kevin Y. Sanbonmatsu
- Kevser Gmen Topal
- Khaled Barakat
- Khanal Rabi
- khannan krishna
- Re: create bonds with uniform pairwise cut off radius for XYZ trajectories. (Fri Sep 26 2014 - 06:14:22 CDT)
- Re: create bonds with uniform pairwise cut off radius for XYZ trajectories. (Fri Sep 26 2014 - 05:05:52 CDT)
- Khuong Truong Gia
- Kiana Jahani
- Kibria Imtiaz Shabbir
- Kim Branson
- Kim Foster
- Kim Gunnerson
- Kim Taylor
- Kim Vilbour Andersen
- Kim, Kwiseon
- kim, stephanie S.
- Kimberly Ann Foster
- Kin Leung CHU
- Kiniu Wong
- Kinkini Jayasundara
- kinshuk_at_chem.iitb.ac.in
- Kipp Johnson
- Kiraly Andras
- Kiran, Kotresh
- Kirby Vandivort
- kirtana S
- Kitzmiller, Nate
- KK R
- KK Sahu
- Klaus Hoffmeier
- Klaus Kramer
- Klimkowski, V
- Klimkowski, Valentine
- Kliuchnikov, Evgenii
- klsale
- KM Tu
- Knapp Bernhard
- knowlesc_at_msu.edu
- Knut Jørgen Bjuland
- Knut Jrgen Bjuland
- Re: PQR parser failure in pqr plugin 0.5 and pqr plugin in latest alpha (Wed Aug 18 2010 - 16:14:53 CDT)
- PQR parser failure in pqr plugin 0.5 and pqr plugin in latest alpha (Wed Aug 18 2010 - 09:11:21 CDT)
- vmd does not read pqr file correct, vmd parse chain information incorrect. (Tue Apr 20 2010 - 09:58:35 CDT)
- vmd does not read pqr file correct, vmd parse chain information incorrect. (Tue Apr 20 2010 - 09:53:57 CDT)
- Knut Teigen
- Kochnev, Iurii K
- Kodituwakku,Dimuthu Nirmani
- kohsj_at_ihpc.a-star.edu.sg
- konda003 .
- Kong, Ren
- kong.winter
- Konrad Hinsen
- Koo Kee Kiat
- Kooser, Ara S
- Korey R
- Kos
- Kotaro Tanaka
- koushik.k
- kovzany_at_go.com
- Kovcs, Sndor dm
- kr_at_isise.rl.ac.uk
- Kraemer, Tobias
- Kramer Campen
- Krigel, Igal
- Kris Feher
- Krishna Suresh
- Krishna Vkm
- Krishnan, Marimuthu
- RE: local packing density around a chemical group (say, a methyl group or a side chain) (Thu Apr 23 2009 - 12:11:07 CDT)
- Kristian Mueller
- Kristin Wunsch
- Kristina Woods
- Kristine Manibog
- Kristy L. Mardis
- Kshatresh Dutta Dubey
- Re: A query about the deletion of Hydrogen and re-adding them by psfgen (Tue Dec 09 2014 - 17:23:07 CST)
- kskeby
- Kuen Phon Wu
- Kuiper, Ben
- Kukol, Andreas
- kumar prashanth
- Kung, Ryan
- Kurt Smith
- Ky Wildermuth
- Kyle Billings
- Kyle Mills
- Kyle Wildermuth
- L. Michel Espinoza-Fonseca
- L. Signorile
- l.spitzer_at_fr.fournierpharma.com
- Rf. : Re: calculate rmsd in a loop:feedback [sorry if you get it twice] (Fri Nov 18 2005 - 04:48:26 CST)
- Rf. : Re: Rf. : calculate rmsd in a loop:feedback [sorry if you get it twice] (Thu Nov 17 2005 - 04:50:45 CST)
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- why electrostatic interaction energy increases with the increase of cutoff using namdenergy (Wed Mar 17 2010 - 21:18:55 CDT)
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- Second Announcement: ‘Hands On’ Workshop on Computational Biophysics (Berkeley, CA, Aug 3-7, 2015) (Tue Jun 16 2015 - 12:04:27 CDT)
- Announcement: Workshop on Simulation Based Drug Discovery (San Diego, CA, Sept 21-25, 2015) (Fri Jun 12 2015 - 21:06:22 CDT)
- Announcement: ‘Hands On’ Workshop on Computational Biophysics (Berkeley, CA, Aug 3-7, 2015) (Wed May 20 2015 - 00:06:46 CDT)
- Announcement: ‘Hands On’ Workshop on Computational Biophysics (Odense, Denmark, Oct 12-16, 2015) (Wed May 06 2015 - 01:39:55 CDT)
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- Re: namd-l: the patch between segments for multiple chains molecule. (Wed Jun 14 2006 - 12:57:42 CDT)
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- Re: Problem While Visualising the Trajectory File from LAMMPS Simulation (Sun Jun 02 2019 - 23:36:37 CDT)
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- Re: Problem with differentiating atoms from different frames for dcd file (Fri Mar 24 2006 - 05:29:55 CST)
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- Re: namd-l: how to use measure hbonds to calculate occupancy of all hbonds in simulation? (Wed May 16 2007 - 09:57:51 CDT)
- loc duong ding
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- Re: "no CUDA accelerator devices available", Nvidia GeForce 9600 GT card (Thu Jun 25 2009 - 00:41:15 CDT)
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- PhD Position In Computational Structural Biology Of Membrane Proteins (Mon Jul 06 2020 - 22:07:44 CDT)
- Immediate postdoc opening in Bio-molecular simulation, University of Alberta, Canada (Wed Jun 19 2019 - 19:16:26 CDT)
- Marc Baaden
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- scripts for binding free energy calculation using SMD and Jarzynski's equality (Wed Aug 17 2005 - 09:45:12 CDT)
- Re: Can vmd select residues in radius of 3.5 to a specific residue? (Fri Mar 18 2005 - 07:59:59 CST)
- Marc van der Kamp
- Marc Zimmer
- Marcel UJI (IMAP)
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- Re: VRPN driver for Novint Falcon haptic device available - Looking for Testers (Wed Oct 17 2012 - 20:58:31 CDT)
- Marcos Sotomayor
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- Margaret Cheung
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- question about using namdenergy.tcl with vmd -dispdev text -e *.tcl (Fri Jul 25 2008 - 08:38:20 CDT)
- Re: VMD 1.8.5 installed. The graphics flashed and disappeared after installation. (Sat Dec 23 2006 - 11:00:18 CST)
- Re: VMD 1.8.5 installed. The graphics flashed and disappeared after installation. (Fri Dec 22 2006 - 12:15:25 CST)
- Re: VMD 1.8.5 installed. The graphics flashed and disappeared after installation. (Thu Dec 21 2006 - 08:04:38 CST)
- Margaret Shun Cheung
- Re: VMD-L: how to select water molecules between two residues in a trajectory. (Mon Apr 17 2006 - 11:16:18 CDT)
- Re: VMD-L: how to select water molecules between two residues in a trajectory. (Mon Apr 17 2006 - 09:38:54 CDT)
- Re: VMD-L: how to select water molecules between two residues in a trajectory. (Sat Apr 15 2006 - 19:15:26 CDT)
- VMD-L: how to select water molecules between two residues in a trajectory. (Sat Apr 15 2006 - 16:54:25 CDT)
- Re: VMD-L: how to rotate the molecule so the long axis will be aligned to Z (Wed Apr 12 2006 - 13:30:05 CDT)
- Re: VMD-L: how to rotate the molecule so the long axis will be aligned to Z (Wed Apr 12 2006 - 11:48:45 CDT)
- Margaret.Cheung_at_mail.uh.edu
- Maria Antonieta Sanchez Farran
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- Re: OpenGL window not rendering over ssh but works when connecting from other computers and works fine locally (Sun Jan 24 2021 - 03:20:17 CST)
- Re: OpenGL window not rendering over ssh but works when connecting from other computers and works fine locally (Fri Jan 22 2021 - 02:21:56 CST)
- maria goranovic
- Yet another python question: how to run a python script from the vmd console ? (Fri Jan 13 2012 - 05:04:16 CST)
- Re: how to draw different set of points for different frames in a trajectory my script does not work (Wed Jul 13 2011 - 08:29:18 CDT)
- Re: how to draw different set of points for different frames in a trajectory my script does not work (Tue Jul 12 2011 - 14:19:51 CDT)
- Re: qpt_conv command of Hole is interactive, how to automate it for multiple frames? (Tue Jul 12 2011 - 14:22:35 CDT)
- Re: how to draw different set of points for different frames in a trajectory my script does not work (Mon Jul 11 2011 - 04:12:11 CDT)
- Re: how to draw different set of points for different frames in a trajectory my script does not work (Fri Jul 08 2011 - 09:56:14 CDT)
- how to draw different set of points for different frames in a trajectory my script does not work (Fri Jul 08 2011 - 07:59:10 CDT)
- Re: qpt_conv command of Hole is interactive, how to automate it for multiple frames? (Thu Jul 07 2011 - 05:21:00 CDT)
- qpt_conv command of Hole is interactive, how to automate it for multiple frames? (Tue Jul 05 2011 - 10:05:55 CDT)
- Re: VMD does not exit after running closest.tcl script in combination with bigdcd (Fri Jun 10 2011 - 04:26:48 CDT)
- Re: VMD does not exit after running closest.tcl script in combination with bigdcd (Fri Jun 10 2011 - 04:36:02 CDT)
- Re: VMD does not exit after running closest.tcl script in combination with bigdcd (Wed Jun 08 2011 - 03:33:23 CDT)
- VMD does not exit after running closest.tcl script in combination with bigdcd (Tue Jun 07 2011 - 04:01:34 CDT)
- Re: trying to combine closewater.tcl with bigdcd.tcl error frame 3 out of range for molecule 0 (Mon Jun 06 2011 - 07:36:35 CDT)
- Re: trying to combine closewater.tcl with bigdcd.tcl error frame 3 out of range for molecule 0 (Wed May 25 2011 - 06:05:44 CDT)
- Re: trying to combine closewater.tcl with bigdcd.tcl error frame 3 out of range for molecule 0 (Wed May 25 2011 - 04:51:02 CDT)
- Re: trying to combine closewater.tcl with bigdcd.tcl error frame 3 out of range for molecule 0 (Tue May 24 2011 - 11:19:26 CDT)
- trying to combine closewater.tcl with bigdcd.tcl error frame 3 out of range for molecule 0 (Tue May 24 2011 - 08:39:08 CDT)
- Re: vmd calculating wrong number of frames in xtc file using molinfo numframes ? (Tue May 24 2011 - 04:45:55 CDT)
- vmd calculating wrong number of frames in xtc file using molinfo numframes ? (Mon May 23 2011 - 10:13:08 CDT)
- using atomselect to write a set of atoms and not some residue whose residue numbers are in a list (Mon Jun 15 2009 - 10:31:26 CDT)
- Re: passing arguments to a vmd script which is executed using play or source (Mon Feb 23 2009 - 09:19:24 CST)
- alignment problem. trying to align new lipid to bilayer, but lipid always has wrong direction? (Tue Apr 22 2008 - 07:02:42 CDT)
- change the representation of certain atoms which pass a geometric criterion during a movie (Tue Sep 18 2007 - 08:21:45 CDT)
- Rebuilding lipid from headgroup coordinates only using psfgen, some atoms put on origin (Wed Sep 05 2007 - 11:05:12 CDT)
- Maria Ivanova
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- Reminder: Hands-On Workshop On Computational Biophysics in Auburn, AL (Fri May 19 2023 - 12:31:05 CDT)
- Re: Question about using fftk with files from QM calculations from Gaussian 16 (Mon May 15 2023 - 13:22:50 CDT)
- Marie Erard
- Marin Paolo Virgile Vatin
- Marinus Veldhuizen
- Re: Re: FFTK partial charge assignment weak acid ONOH (HNO2) - Water Shift settings (Mon Oct 07 2024 - 09:30:35 CDT)
- Mario Saavedra
- Re: Symmetry Tool Error (Draw): invalid command name "getargs" and expected integer but got "" (Thu Apr 29 2010 - 13:47:24 CDT)
- Mario Schubert
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- Re: Script to impose coordinates from separate file onto equivalent selection of atoms (Thu Mar 26 2015 - 12:53:29 CDT)
- Re: Extracting complex of protein-ligand+water from every frame of DCD trajectory. . (Tue Feb 18 2014 - 14:50:23 CST)
- RE: VMD can't display new PDB secondary structure properly ( pyMol, jMol can). . (Mon Nov 19 2012 - 20:37:26 CST)
- Martina Devi
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- Re: Fwd: Problem with Loading Bond Angle Optimization Gaussian .log file into the fftk (Thu Nov 02 2017 - 09:27:35 CDT)
- Matt Elder
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- matt_at_clarkeconsulting.com
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- max_at_liaad.up.pt
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- Re: building a solvent/gas filled simulation box, no protein inside (Fri Feb 05 2016 - 14:20:04 CST)
- Re: building a solvent/gas filled simulation box, no protein inside (Fri Jan 29 2016 - 14:18:57 CST)
- Re: building a solvent/gas filled simulation box, no protein inside (Fri Jan 29 2016 - 13:26:21 CST)
- Re: Residues within a specified distance across all trajectories time steps (Mon Apr 06 2015 - 15:49:59 CDT)
- Re: ??startup.command?? can??t be opened because CoreServicesUIAgent is not allowed to open documents in Terminal. (Mon Apr 06 2015 - 13:29:18 CDT)
- Re: Any interest in VMD supporting mirror reflections w/ ray tracing? (Thu Nov 27 2014 - 21:27:45 CST)
- Re: Re: Need testers: VMD 1.9.2 w/ interactive GPU ray tracing w/ AO, depth of field, etc. (Thu Nov 27 2014 - 12:27:54 CST)
- Re: Problem with merging structures!( psfgen) Warning: failed to set coordinate for atom AU0 AU:1 A) (Wed Nov 26 2014 - 18:00:19 CST)
- Maxim Kholin
- Maxim Paliy
- "Sorry, this version VMD was compiled with Python support disabled" (Wed Feb 04 2009 - 09:19:49 CST)
- accessing bonds angles dihedrals etc lists after PSF file is read into VMD (Wed Jan 21 2009 - 15:29:54 CST)
- a VMD script similar to "Rahmachandran plot' applicable to nucleic acids ? (Fri Sep 12 2008 - 19:14:04 CDT)
- Maxim Paliy.
- maxim todoru
- Maximilian Ebert
- Re: ABF tutorial: Methane-Hydration water going -> Water in gas phase? (Sat May 04 2013 - 08:32:23 CDT)
- Re: Load a molecule in a function without output and slow Tcl gui console (Wed Feb 27 2013 - 15:59:32 CST)
- Mayank
- Mayne, Christopher G
- Re: VMD ffTK plugin: Error termination occurred at Gaussian input files generated for water interaction (Sat Jan 20 2018 - 20:05:43 CST)
- Re: ffTK: neutral pyruvate group and charged pyruvate group at beta-D-mannose (Thu Jul 27 2017 - 22:52:49 CDT)
- Re: Ideal charge optimization strategy for atoms with existing ff parameters (Mon Oct 19 2015 - 09:50:09 CDT)
- Re: Ideal charge optimization strategy for atoms with existing ff parameters (Fri Oct 16 2015 - 02:50:39 CDT)
- Re: getting extra number of input file at the charge optimization phase/ ffTK (Wed Dec 03 2014 - 15:58:46 CST)
- Re: Charge Optimization error: error deleting "base-wat.pdb": permission denied (Sat Nov 08 2014 - 11:29:31 CST)
- Re: Charge Optimization error: error deleting "base-wat.pdb": permission denied (Sat Nov 08 2014 - 10:11:49 CST)
- Re: namd-l: Re: ffTK problem: initial parameter file is void of atoms! (Mon Oct 20 2014 - 14:19:29 CDT)
- Re: namd-l: Re: ffTK problem: initial parameter file is void of atoms! (Mon Oct 20 2014 - 13:05:04 CDT)
- Re: "OpenGL Display" and "VMD Main" windows; size and location on launch (Mon Sep 29 2014 - 09:12:59 CDT)
- Re: ffTK generated Gaussian file puts "atoms too close" and Gaussian fails to run (Mon Apr 07 2014 - 12:55:08 CDT)
- Re: ffTK generated Gaussian file puts "atoms too close" and Gaussian fails to run (Fri Apr 04 2014 - 11:08:13 CDT)
- Re: fftk optimization of bonded parameters + Error: missing close-bracket (Wed Oct 30 2013 - 07:42:33 CDT)
- Re: force field tool kit - error in the step of tutorial charges optimization 2-using vmd1.9.1 (Thu Sep 19 2013 - 08:14:38 CDT)
- Re: Error during Water interaction data generation using gaussian following ffTK screencast (Wed Jul 10 2013 - 14:19:40 CDT)
- Re: namd-l: Re: Suggestions on parameterizing a ligand to simulate in NAMD (Thu Jun 13 2013 - 15:55:52 CDT)
- Re: charge exceed the range between Low bound and High bound in ffTK charge optimization (Fri Jun 07 2013 - 09:29:16 CDT)
- Re: namd-l: Re: Suggestions on parameterizing a ligand to simulate in NAMD (Tue May 21 2013 - 16:55:01 CDT)
- Re: namd-l: Re: Suggestions on parameterizing a ligand to simulate in NAMD (Tue May 21 2013 - 15:46:07 CDT)
- Re: namd-l: Re: Suggestions on parameterizing a ligand to simulate in NAMD (Tue May 21 2013 - 13:05:04 CDT)
- Re: namd-l: Re: Suggestions on parameterizing a ligand to simulate in NAMD (Tue May 21 2013 - 07:59:25 CDT)
- Re: Question about FFTK charge optimization procedure to CGENFF modeling (Sat May 04 2013 - 09:37:11 CDT)
- Re: FATAL ERROR: UNKNOWN PARAMETER IN CHARMM PARAMETER FILE toppar_water_ions.str LINE=*set nat ?NATC* (Wed Apr 17 2013 - 22:18:05 CDT)
- Re: FATAL ERROR: UNKNOWN PARAMETER IN CHARMM PARAMETER FILE toppar_water_ions.str LINE=*set nat ?NATC* (Wed Apr 17 2013 - 14:11:45 CDT)
- Re: Is it necessary to set up more than 1 hydrogen bonding for one Acceptor in Water Int. in ffTK (Wed Apr 17 2013 - 13:14:08 CDT)
- Re: Is it necessary to set up more than 1 hydrogen bonding for one Acceptor in Water Int. in ffTK (Wed Apr 17 2013 - 12:51:05 CDT)
- Re: Is it necessary to set up more than 1 hydrogen bonding for one Acceptor in Water Int. in ffTK (Wed Apr 17 2013 - 12:26:35 CDT)
- Re: Is it necessary to set up more than 1 hydrogen bonding for one Acceptor in Water Int. in ffTK (Wed Apr 17 2013 - 09:52:43 CDT)
- Re: Is it necessary to set up more than 1 hydrogen bonding for one Acceptor in Water Int. in ffTK (Wed Apr 17 2013 - 08:00:26 CDT)
- Re: VMD can't display new PDB secondary structure properly (pyMol, jMol can) (Mon Nov 19 2012 - 18:46:09 CST)
- Re: Application Error message during dihedral optimization using FFTK (Fri Oct 19 2012 - 07:34:49 CDT)
- Re: Error message -" cannot find NAMD binary files" during parameterization using FFTK plugin. (Thu Oct 11 2012 - 14:55:38 CDT)
- Re: Error message -" cannot find NAMD binary files" during parameterization using FFTK plugin. (Thu Oct 11 2012 - 13:09:21 CDT)
- Re: High Bound charge values missing during charge optimization in FFTK (Thu Sep 27 2012 - 11:15:31 CDT)
- Re: namd-l: Re: FFTK VMD plugin issue (arising from VECSCALE TCL issues of either NAMD or VMD ?) (Tue Jun 05 2012 - 13:27:13 CDT)
- Mayra Underwood
- mbb
- mbcx7sa3_at_zedat.fu-berlin.de
- mbelkin_at_ks.uiuc.edu
- mbyr8097_at_mail.usyd.edu.au
- McCullough, Scott
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- Mckellan S Gonzales
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- MD Simulation
- mdcooper
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- MERIC AYSE OVACIK
- Mert Gr
- Re: How can I draw secondary structures if I only have the carbon alpha coordinates (Thu Aug 18 2011 - 12:20:30 CDT)
- Meunier, Vincent
- Meyer, Douglas K \(UMC-Student\)
- Meyer-Almes, Franz-Josef, Prof. Dr.
- mfeiglab_at_gmail.com
- Mgr. Lubos Vrbka
- Mi Yang
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- Re: Creating multiple views from same trajectory file for movie generation (Fri Oct 03 2014 - 05:45:02 CDT)
- Michael F. Harrach
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- Michael Klein
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- Michael LeVine
- Electrostatic interaction calculations using the NAMD Energy Plugin and PME (Tue Sep 12 2017 - 09:37:30 CDT)
- Re: How to select whole residues when at least one atom is within a specific distance (Thu Oct 13 2011 - 16:57:26 CDT)
- Michael Morgan
- Michael Morin
- Michael Murray
- Michael Mwalaba
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- Michael.Grabe_at_ucsf.edu
- michaelmorgan937_at_gmail.com
- Michail Lazaratos
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- Michal Kolinski
- Micha Jakub Kaski
- Michał Kadlof
- Michel Espinoza-Fonseca
- RE: Loading multiple molecules in one step / "Apply changes automatically" (Fri Oct 21 2005 - 10:46:46 CDT)
- Michel Sanner
- Michela Candotti
- Michele Andrews - Contractor
- Michele Formica
- Michele Garrett
- Michele Seeber
- Michetti Davide
- Miguel
- Miguel Caro
- Re: Moving atoms so that origin is at fixed position with respect to the display (Fri Oct 27 2017 - 08:43:14 CDT)
- Miguel Ferreira
- Miguel Ortiz Lombarda
- Miguel Teodoro
- Miguel Valvano
- Mihaela Drenscko
- Mihaljevic-Juric Paula (Mme)
- Mihaly Mezei
- Mihir Tungare
- Mike Doolin
- Mike Hanby
- Mike Makowski
- Mike McCallum
- MIke S
- Mike Smith
- Mike Wykes
- Mikhail Suyetin
- Mikkel Vestergaard
- Mikko Huhtala
- Mikolai Fajer
- Miller, Patrick
- mimurra3
- Min Chin Chai
- Min Wu
- Minerva Gonzalez
- Ming Tang
- Ming-Tsung Lee
- problem for VMD extension_radial pair distribution function_truncation (Fri Mar 21 2014 - 10:23:22 CDT)
- Mingchao Wang
- Mingliang Tan
- Minh Ho
- Minhaj
- Minjung Godfrey
- Mintare Cesiunaite
- mirandaisbest
- Mirco Wahab
- Miro Astore
- Miroslav Krepl
- mish
- mishacat_at_udm.ru
- Misraim Enrique Gurrola Acosta
- Mithun Mitra
- Mitul Saha
- miyatake
- miyatake_at_riken.jp
- MJR
- mjyang
- Mo Rahman
- moacyr comar
- Mochena, Mogus D.
- Moeed
- moggces
- moggces_at_rx.mc.ntu.edu.tw
- mohamad rahimi
- mohamed marzouk
- Mohamed Osman
- Mohamed Seyam
- mohammad agha
- Mohammad Elgamacy
- MOHAMMAD JAVAD AGHAEI
- Mohammad Khalkhali
- mohammad rezaei
- Mohammadi, Mohammadjavad
- Mohammadjavad Mohammadi
- Mohammed GOUNZARI
- Mohan maruthi sena
- Re: force field tool kit - error in the step of tutorial charges optimization 2-using vmd1.9.1 (Thu Sep 19 2013 - 04:52:34 CDT)
- force field tool kit - error in the step of tutorial charges optimization 2-using vmd1.9.1 (Thu Sep 19 2013 - 03:38:09 CDT)
- Mohd Farid Ismail
- Mohsen Farshad
- molecular dynamics
- Molybdos Kirkimpolakis
- mon_sharma_at_research.iiit.ac.in
- Mona Gomes
- Mona Habibi
- Monika Kumari
- Monika Madhavi
- Re: Is there a way to create atom selection for a list of atom indices? (Thu Mar 29 2018 - 02:23:53 CDT)
- Same starting configuration gives two starting values of backbone RMSD (Fri Dec 15 2017 - 05:52:39 CST)
- What is the correct way of using "pbcwrap" with "atomselect [within]"? (Tue Feb 02 2016 - 01:34:46 CST)
- conversion of topology entries from charmm str format to vmd psfgen format (Tue Sep 15 2015 - 05:40:06 CDT)
- Re: How to write coordinates to a pdb without replacing existing entries (Mon Jul 06 2015 - 22:57:49 CDT)
- Re: How to write coordinates to a pdb without replacing existing entries (Mon Jul 06 2015 - 04:01:35 CDT)
- Re: How to write coordinates to a pdb without replacing existing entries (Sun Jul 05 2015 - 23:55:29 CDT)
- Re: How to write coordinates to a pdb without replacing existing entries (Thu Mar 12 2015 - 03:51:49 CDT)
- Re: How to write coordinates to a pdb without replacing existing entries (Mon Mar 09 2015 - 05:26:18 CDT)
- Re: How to write coordinates to a pdb without replacing existing entries (Mon Mar 09 2015 - 01:24:11 CDT)
- RE: How to write coordinates to a pdb without replacing existing entries (Sun Mar 08 2015 - 12:17:16 CDT)
- Re: How to write coordinates to a pdb without replacing existing entries (Sun Mar 08 2015 - 12:33:29 CDT)
- Monika Sharma
- Monique Laberge
- Monoj Mon Kalita
- Montoya, Jesus Gerardo Galaz
- Montserrat Fabrega Ferrer
- Morad Alawneh
- Morgan Hoffman
- Morgan, Brittany
- Moritz Mnsterberg
- Morizono, Hiroki
- Morrissey, Liam S.
- morten stergaard jensen
- Morteza Chehel Amirani
- Morteza Jalalvand
- Mortimer Hemmit
- Moslem Sabouri
- Moulton, Steve
- Moumita Maiti
- Moumita Saharay
- Moutusi Manna
- mpincu
- MQO. Carlos Javier Núñez Aguero
- Mr Bernard Ramos
- mr.ibid_at_gmail.com
- mrg28_at_drexel.edu
- Mubarak Alamri
- MUHAMMAD IMTIA SHAFIQ
- Muhammad Radifar
- Muhammad tariq
- Muhammet smet Treh Balta
- Munir Ahmad
- muniyamuthu.raviprasad_at_ndsu.edu
- MUNUBARTHI KRANTHI KUMAR
- Muralikrishna Raju
- Murilo Kramar
- Murpholino Peligro
- Murray Dyer
- Mustafa Burak Boz
- Mustafa Tekpinar
- mustapha.hamdi_at_ensi-bourges.fr
- Muthukumaran Rajagopalan
- MVACKEL
- MW Van der Kamp, School of Chemistry
- MyLinkka
- Myunggi Yi
- Mhlbacher, Markus
- N. Chitra
- nabaneeta mukhopadhyay
- nabil Khalil
- Nada Afiva
- Nadia Vahdati
- nadiav_at_soton.ac.uk
- Nadine Utz
- Nadine Utz (Abt. Koslowski)
- Nadira Khatoon
- Nadja Lederer
- Naeem Mahmood Ashraf
- naga raju
- Re: Selecting water molecules within 5 ang in a trajectory( generated by amber). (Sat Dec 29 2007 - 00:02:12 CST)
- Nagarajan C
- Nagendra Prasad
- nahren manuel
- Naiyin Yu
- Nakshatra Upadhyay
- Re: Two different type of color set for potential map of overlapped molecules (Fri Oct 04 2024 - 02:16:54 CDT)
- namd vmd
- NAMITA BHADRA
- Nanako Takahashi
- Nance, Sierra
- Nancy Singh
- Nandigana, Vishal Venkata Raghave
- Nara Dashdorj
- Narasimhan LOGANATHAN
- Narayanan Veeraraghavan
- Narender Singh Maan
- Naresh
- Naser, Md Abu
- Naser, Md Abu
- Nash, Anthony
- Natal Kanaan
- nataliaperez_at_infomed.sld.cu
- Nate Abraham
- Nate Hurley
- Nathan C. Rockwell
- Nathan K Houtz
- Nathan Kern
- Nathan Li
- Nathan M. Lim (UCI)
- Nathaniel Eagan
- Natnael Doilicho
- Navdeep
- Naveen BK
- Navendu bhatnagar
- Navid Shervani-Tabar
- Nazanin Samadi
- nbabcock_at_qis.ucalgary.ca
- Nd S
- Neale, Christopher Andrew
- nealec
- Re: Using the chirality and cispeptide plugins with "vmd -dispdev text" (Fri Dec 12 2014 - 23:55:20 CST)
- Ned Roy
- Neda Rafieiolhosseini
- Re: Problem with Surf representation in the latest version macOS Catalina (Mon Apr 27 2020 - 16:14:03 CDT)
- Neelanjana Sengupta
- Re: residue selection (water molecule within 5 ang. to protein in simulation) (Sun Oct 14 2007 - 08:05:40 CDT)
- Re: Re: pbc: relation of orthonormalizing; cart. coords; rotation matrices. (Mon Oct 09 2006 - 09:48:49 CDT)
- Re: pbc: relation of orthonormalizing; cart. coords; rotation matrices. (Thu Oct 05 2006 - 12:17:57 CDT)
- Neena Susan Eappen
- Neeraj
- Neeraj Agrawal
- Neeraj Dhandia
- Neeraj Jagdish Agrawal
- Negar Ashari Astani
- Neha Gupta
- Neil Henson T-12
- Nels Thorsteinson
- nepenthes_at_vplaces.net
- nettles
- NG HUI WEN
- ngpntm_at_gmail.com
- Nguyen Hoang Phuong
- niaz poorgholami
- Nibedita Ray Chaudhuri
- nicholas blake
- Nicholas Labello
- nicholas lee
- Nicholas Musolino
- Nichols A. Romero
- Nicholson, James D Mr ARO
- Nick Bayhi
- Nick Fisher
- Nick I
- Nick Palmer
- Nicola De Mitri
- Nicola Giacche'
- Nicolas
- Nicolas Belloy
- Nicolas Bigaouette
- Nicolas CHARVIN
- Nicolas Coudray
- Nicolas Floquet
- Nicolas Foloppe
- Nicolas Martin
- Nicolas Sapay
- Nicolas Tilmans
- nicolas.floquet_at_univ-reims.fr
- NICOLÁS DÍAZ ROUSSEL
- Nicolás Veiga
- Nidhi Jatana
- Niels Mller
- Nifeng Guo hui
- Re: Fwd: namd-l: Why RDF increases as r increase instead of constant (Tue Nov 04 2014 - 13:07:26 CST)
- Re: Fwd: namd-l: Why RDF increases as r increase instead of constant (Tue Nov 04 2014 - 10:58:23 CST)
- Re: Fwd: namd-l: Why RDF increases as r increase instead of constant (Mon Nov 03 2014 - 15:29:25 CST)
- Nikhil Maroli
- psf for cyclic peptide nanotube:psf ready for one ring but required for 8 ring (Sat Sep 26 2015 - 06:50:31 CDT)
- Niklas.Blomberg_at_astrazeneca.com
- nikolaev_at_spbau.ru
- Nikolai Smolin
- Nikolaos Galanakis
- Nikolay Simakov
- niladri patra
- Nilesh Ingle
- Nima Emadi
- Nima Nouri
- Nima Soltani
- Nir London
- Nirmitee Mulgaonkar
- Nisler, Collin R.
- Nithin Rai
- Nitin Bhardwaj
- Nitin Rathore
- Nixon Raj
- nlabello
- nmichaud_at_jhu.edu
- no tengo nombre
- noel.oboyle2_at_mail.dcu.ie
- Norbert Straeter
- Re: Re: Re: Using BigDCD on Simulation Files Located on Mapped Network Drive (Wed Oct 12 2022 - 03:02:29 CDT)
- Re: Re: Using BigDCD on Simulation Files Located on Mapped Network Drive (Tue Oct 11 2022 - 14:33:49 CDT)
- Re: Using BigDCD on Simulation Files Located on Mapped Network Drive (Tue Oct 11 2022 - 14:05:57 CDT)
- Norberto Martinez
- nordgren_at_sas.upenn.edu
- Norfarisha Mohd Fadil
- Norge Cruz Hernández
- Noriaki Okimoto
- Norman Geist
- AW: Re: namd-l: Is there someway to render protein picture without background color? (Thu Sep 19 2019 - 04:13:05 CDT)
- AW: regarding the coordinate transformation on a curved surface to plane surface (Wed Jan 09 2019 - 02:13:09 CST)
- AW: Error connecting to localhost on port 3000 and IMD connection ended unexpectedly; connection terminated. (Thu Oct 27 2016 - 07:50:51 CDT)
- AW: Selecting atoms of same type in a certain distance (between X and Y angstroms away) (Thu Jun 23 2016 - 01:22:06 CDT)
- AW: Selecting atoms of same type in a certain distance (between X and Y angstroms away) (Wed Jun 22 2016 - 10:58:55 CDT)
- Namdenergy BUG: Namd started without initial box info, pairlist invalid (Tue May 24 2016 - 03:02:26 CDT)
- AW: TCL script to track molecules moving within a specified region each time frame (Tue May 17 2016 - 00:02:49 CDT)
- AW: Unable to visualize my polymer chains generated using RIS theory using VMD properly (Wed Mar 16 2016 - 04:56:34 CDT)
- AW: Unable to visualize my polymer chains generated using RIS theory using VMD properly (Tue Mar 15 2016 - 02:53:21 CDT)
- AW: printing out trajectories with some random indices of atoms renamed frame by frame (Mon Mar 07 2016 - 01:07:22 CST)
- RE: How to write coordinates to a pdb without replacing existing entries (Mon Jul 06 2015 - 04:58:16 CDT)
- RE: How to write coordinates to a pdb without replacing existing entries (Mon Jul 06 2015 - 02:28:01 CDT)
- RE: Running 64-bit Linux VMD in VMWare VM on Windows 8.1 64-bit Host Machine (Mon May 18 2015 - 02:47:21 CDT)
- RE: How to continue the calculation of NAMD in case of power failure? (Mon May 18 2015 - 02:56:39 CDT)
- RE: How to write coordinates to a pdb without replacing existing entries (Mon Mar 09 2015 - 06:08:36 CDT)
- RE: How to write coordinates to a pdb without replacing existing entries (Mon Mar 09 2015 - 04:42:44 CDT)
- AW: AW: namd-l: FATAL ERROR: seek failed while writing DCD file: No such file or directory (Fri Dec 19 2014 - 02:45:26 CST)
- AW: format I should use if I have different total number of atoms for each timesteps (Fri Dec 12 2014 - 02:43:08 CST)
- AW: Any interest in VMD supporting mirror reflections w/ ray tracing? (Thu Nov 27 2014 - 10:31:26 CST)
- AW: Re: Need testers: VMD 1.9.2 w/ interactive GPU ray tracing w/ AO, depth of field, etc. (Thu Nov 27 2014 - 03:19:00 CST)
- AW: Re: Need testers: VMD 1.9.2 w/ interactive GPU ray tracing w/ AO, depth of field, etc. (Wed Nov 26 2014 - 02:32:21 CST)
- AW: How to remove particular residues and then view "ramachandran plot" in VMD (Thu Oct 09 2014 - 07:05:14 CDT)
- AW: "OpenGL Display" and "VMD Main" windows; size and location on launch (Mon Sep 29 2014 - 00:49:34 CDT)
- AW: Does the VMD Linux 64-bit version perform better than the Windows 32-bit when visualizing large molecules? (Wed Aug 06 2014 - 00:35:18 CDT)
- AW: measure Hbond and orient (with vec {0 0 1}) of a selected molecule (Fri Apr 25 2014 - 06:36:35 CDT)
- AW: measure Hbond and orient (with vec {0 0 1}) of a selected molecule (Fri Apr 25 2014 - 05:39:11 CDT)
- AW: measure Hbond and orient (with vec {0 0 1}) of a selected molecule (Fri Apr 25 2014 - 02:49:20 CDT)
- AW: measure Hbond and orient (with vec {0 0 1}) of a selected molecule (Fri Apr 25 2014 - 01:13:38 CDT)
- AW: TCL scripting question: how to make a list of atomselections persistent? (Fri Mar 28 2014 - 03:02:24 CDT)
- AW: TCL scripting question: how to make a list of atomselections persistent? (Fri Mar 28 2014 - 03:00:02 CDT)
- Norouzi, Seyed
- nsapay_at_ibcp.fr
- NSTI Nanotech Ventures
- Nuno Cerqueira
- Nuno Loureiro Ferreira
- Nuno R. L. Ferreira
- Re: Re: Rf. : calculate rmsd in a loop:feedback [sorry if you get it twice] (Thu Nov 17 2005 - 04:34:44 CST)
- Nuno Ricardo Loureiro Ferreira
- Nuno Sousa Cerqueira
- nunolf_at_ci.uc.pt
- nupur bansal
- nur avneet
- O'Reilly Science Art
- Ocar Campos
- Oded Kleifeld
- oguz gurbulak
- Olaf Lenz
- Re: PhD position in Computational Structural Biology at MPI Muenster (Sun May 15 2011 - 10:34:40 CDT)
- Re: .xst file disagrees with pbctools/.dcd file - what are the limitations of pbctools? (Thu Jul 16 2009 - 01:14:37 CDT)
- Re: vmd 1.8.7 not spawn new console: feature,bug, or just different? (Thu Jun 25 2009 - 00:52:39 CDT)
- Re: measure hbonds between protein and water - problem with periodic boundary conditions (Thu Apr 17 2008 - 05:19:52 CDT)
- Re: measure hbonds between protein and water - problem with periodic boundary conditions (Thu Apr 17 2008 - 04:32:34 CDT)
- Oleg Stroganov
- Oleg V. Stroganov
- Oleksii Zdorevskyi
- Olesya Haze
- olga hrydziuszko
- Olga Kravchenko
- Olimpia Popko
- Oliver Beckstein
- Oliver Grant
- Oliver Inderwildi
- Oliver Lanning
- Oliver Otto
- Re: Test version of VMD 1.8.4 for Linux/IA64 (SGI Prism, Altix, etc..) (Wed Jul 06 2005 - 12:38:43 CDT)
- Re: Test version of VMD 1.8.4 for Linux/IA64 (SGI Prism, Altix, etc..) (Thu Jun 23 2005 - 05:32:24 CDT)
- Oliver Schillinger
- Oliver Schmetzer
- Oliver Stenning
- Oliver Srensen Siig
- Oliver Wenisch
- Olivia Reilly
- olivier Walker
- Olve Peersen
- Olya Kravchenko
- Re: is there any plugin or software to combine PMF trajectory with VMD image? (Wed Feb 08 2017 - 14:45:52 CST)
- is there any plugin or software to combine PMF trajectory with VMD image? (Wed Feb 08 2017 - 11:11:16 CST)
- Re: solvate fails to set coordinates for the first few residues of the first chain? (Wed Apr 20 2016 - 10:57:07 CDT)
- solvate fails to set coordinates for the first few residues of the first chain? (Tue Apr 19 2016 - 14:59:01 CDT)
- Re: building a solvent/gas filled simulation box, no protein inside (Thu Feb 04 2016 - 20:53:17 CST)
- Re: building a solvent/gas filled simulation box, no protein inside (Thu Feb 04 2016 - 21:23:13 CST)
- Re: building a solvent/gas filled simulation box, no protein inside (Fri Jan 29 2016 - 13:36:24 CST)
- OMAR NABEEL ALY DEMERDASH
- omid gh
- Omololu
- Ondrej Kroutil
- Ondrej Marsalek
- Ondrej Sramek
- Onur Alptrk
- OPC3_at_pitt.edu
- Oren Elrad
- Orsolya Karcsony
- Oscar Bastidas
- Oscar Moran
- Osman Barış Malcıoğlu
- Osman, Roman
- Osmany Guirola Cruz
- Otakandza Glenn
- Owen Lindsay
- Owen Vickery
- Ozan Dernek
- OZGE ENGIN
- Re: Re: unusual bond between the cysteine and arginine residue during the simulation (Fri Feb 29 2008 - 15:01:10 CST)
- unusual bond between the cysteine and arginine residue during the simulation (Fri Feb 29 2008 - 13:30:01 CST)
- Re: Re: the script do not update the frame number for secondary structure analysis (Mon Feb 11 2008 - 04:01:15 CST)
- the script do not update the frame number for secondary structure analysis (Sun Feb 10 2008 - 05:18:46 CST)
- Ozgun Kirker (Student)
- P A Deshpande
- P C Kroon
- P.-L. Chau
- p.w.fowler_at_qmul.ac.uk
- Pablo Alfonso Madero Ayala
- Pablo De Biase
- Pablo M. De Biase
- Pablo Villalobos Navarro
- Pacci Evaristo, Felipe Fabricio
- Re: VMD 1.9.4a50 test versions for MacOS Big Sur -- both x86 and ARM64 (M1) (Mon Dec 14 2020 - 11:27:17 CST)
- Pacho Ramos
- Pallab Dutta
- Palmer, Teresa
- Panagiota Georgoulia
- PANAGIOTA KYRIAKOU
- Panagiotis Lagarias
- Pang, Yui Tik
- Panichakorn Jaiyong
- Paolo Conflitti
- Papan S
- paquotau_at_loria.fr
- parinaz bashirbanaem
- Parisa Akhski
- Parker de Waal
- PARMINDER MANKOO
- Parth Chaturvedi
- parth singh
- Parul tew
- Parvez Mh
- Parviz Seifpanahi Shabane
- Pascal Bonnet
- pascal boulet
- Pascal Mercier
- pascal.baillod_at_epfl.ch
- Pascale Geysermans
- Passerone, Daniele
- Pat Yee
- Patargias, George
- Patric Beuthen
- Patricia Soto
- Patrick Buck
- Patrick Burney
- Patrick Charchar
- RE: measure rmsd with non-serial atom ordering between two selections (Tue May 07 2019 - 20:16:32 CDT)
- Patrick Fleming
- Patrick Kiley
- Patrick Ladam
- Patrick Osmer
- Patrick Redmill
- patrick wintrode
- Patrik Molnár
- Patrycja
- Pattanayek, Sabuj
- Patti Schaefer
- Patzschke, Dr. Michael
- Paul Anderson
- Paul Christopher Millett
- paul d jones
- Paul D. Jones
- Paul Daniel Jones
- Paul Darwen
- Paul Dennis Simonson
- Paul Fons
- Paul Grayson
- Paul Hubbard
- PAUL NEWMAN
- Paul O'Leary
- Paul R Brenner
- Re: Outputing Dihedral Indexes for key structures (backbone, alpha-helix, etc...) (Tue Feb 01 2005 - 21:47:38 CST)
- Paul Schlesinger
- Paul T. Bauman
- Paul Tangney
- Paul Van Allsburg
- Paul VanAllsburg
- Paul Whitford
- Paul, Kristian (Cont, ARL/WMRD)
- Paula Marcela Petrone
- Paula Mihaljevic-Juric
- Paula Schneider
- Paulo E. Abreu
- PaulW
- Pavan Ghatty
- Pavan Miriyala
- Re: How to get all bond angles and bond distances for all atoms in sheet (Wed Sep 03 2014 - 10:14:35 CDT)
- Re: How to get all bond angles and bond distances for all atoms in sheet (Wed Sep 03 2014 - 10:23:12 CDT)
- Re: How to get all bond angles and bond distances for all atoms in sheet (Wed Sep 03 2014 - 05:05:03 CDT)
- Re: How to get all bond angles and bond distances for all atoms in sheet (Wed Sep 03 2014 - 02:08:45 CDT)
- Re: How to get all bond angles and bond distances for all atoms in sheet (Wed Sep 03 2014 - 01:21:35 CDT)
- Re: How to get all bond angles and bond distances for all atoms in sheet (Tue Sep 02 2014 - 07:11:05 CDT)
- pavan.vmd_at_gmail.com
- Pavel Macek
- Pawel Kedzierski
- Re: BFEE plugin error: 'measure center: bad weight sum would cause divide by zero' (Thu Apr 22 2021 - 10:43:27 CDT)
- Re: BFEE plugin error: 'measure center: bad weight sum would cause divide by zero' (Thu Apr 22 2021 - 08:42:25 CDT)
- Re: VMD from remote workstation (followup: crash with Intel drivers) (Wed Oct 11 2017 - 03:39:23 CDT)
- Re: VMD from remote workstation (followup: crash with Intel drivers) (Tue Oct 10 2017 - 06:21:30 CDT)
- Re: what is difference between "TOTAL", Q=80=9cTOTAL2=22_and_=22POTENTIAL=22_in_the_VMD_plugin_NAMD_Plo?= t? (Mon Nov 09 2015 - 04:09:48 CST)
- Re: Problems with S-Adenosyl-L-Methionine / SAM Topology & Parameter for MD simulations (Sun Oct 11 2015 - 08:33:33 CDT)
- Re: How to extract data from NAMD log file for viscosity calculation (Wed Aug 19 2015 - 09:23:22 CDT)
- Pawel Sikorski
- Pawel Siuda
- Pawel Weronski
- Pawel Wielgus
- Pawe Kdzierski
- Paweł Kędzierski
- Re: Re: ffTK Parameter Selection i.e. just Scan and Opt Torsion Selection Viable? (Tue Feb 20 2024 - 07:29:39 CST)
- Re: Anyone Completed ffTK Calc Bonded Tab using ORCA gbw instead of Gaussian chk? (Tue Feb 20 2024 - 01:32:05 CST)
- Re: loading PDBs with multiple states having different numbers of atoms in VMD (Wed Jul 14 2021 - 04:30:29 CDT)
- Re: Selecting a laptop for VMD and NAMD (was: CUDA cores seen by VMD on GT540M) (Tue Sep 27 2011 - 09:29:31 CDT)
- Paweł Wolski
- Payal Chatterjee
- Payman Pirzadeh
- Paymon Pirzadeh
- Payne, Christina M
- Payne, Christy
- pbrenne1_at_nd.edu
- pebblepeddle_at_gmail.com
- Pedley, Anthony M
- Peitong Duan
- Peixi Zhu
- peng liu
- Peng Tao
- Penny Boyle
- Per Jr. Greisen
- Per Larsson
- Perreault, Roger Edward
- Pete Kekenes-Huskey
- petefred_at_ks.uiuc.edu
- Peter
- Peter Bazeley
- Peter C. Lai
- Peter Carlsson
- Peter Dek
- Peter Engelhardt
- Peter Freddolino
- Re: Why do the coordinates of my atoms change when writing to a pdb file? (Sun Mar 21 2021 - 16:01:32 CDT)
- Re: Why do the coordinates of my atoms change when writing to a pdb file? (Sun Mar 21 2021 - 10:36:48 CDT)
- Re: Discrepancy in interaction energy of amber coordinate trajectories of a system (Fri Nov 20 2020 - 11:47:47 CST)
- Re: Discrepancy in interaction energy of amber coordinate trajectories of a system (Mon Nov 09 2020 - 00:15:42 CST)
- Re: Discrepancy in interaction energy of amber coordinate trajectories of a system (Sat Nov 07 2020 - 19:35:23 CST)
- Re: TCL script for creating multiple representations on the same molecule (Wed Sep 30 2020 - 21:22:36 CDT)
- Re: Re: Error with initiation of additional production simulation using Qwikmd (Thu Jul 30 2020 - 10:02:09 CDT)
- Re: Calculate the bond and angle energy of a glucosidic linkage using NAMD Energy plugin (Mon Feb 25 2019 - 07:47:05 CST)
- Re: which water models are inbult in namd? can I use SPCE if yes how? (Wed Nov 16 2016 - 08:57:32 CST)
- Re: Namdenergy BUG: Namd started without initial box info, pairlist invalid (Tue May 24 2016 - 07:40:30 CDT)
- Re: building a solvent/gas filled simulation box, no protein inside (Sat Jan 30 2016 - 19:28:40 CST)
- Re: tcl scripting for adding hydrogens to particular atoms in multiple pdb files (Thu Jan 28 2016 - 14:21:18 CST)
- Re: tcl scripting for adding hydrogens to particular atoms in multiple pdb files (Thu Jan 28 2016 - 00:00:28 CST)
- Re: namd CG minimization error: unable to find angle parameters for nxg nxx nxg (Thu Dec 10 2009 - 15:06:05 CST)
- Re: accessing bonds angles dihedrals etc lists after PSF file is read into VMD (Thu Jan 22 2009 - 18:38:36 CST)
- Re: question about using namdenergy.tcl with vmd -dispdev text -e *.tcl (Fri Jul 25 2008 - 17:31:16 CDT)
- Re: Fwd: memory overflow problem of Tcl scripting when dealing with trajectories(sorry for cross mailing...) (Wed Jul 16 2008 - 07:20:26 CDT)
- Re: namd-l: NAMDENERGY: function of 'cutoff' parameter when -pme option is enabled (Tue May 06 2008 - 00:37:54 CDT)
- Re: Re: topology file in /linux/src/vmd-1.8.6/plugins/noarch/tcl/readcharmmtop1.0/top_all27_prot_lipid_na.inp (Tue Sep 25 2007 - 21:05:12 CDT)
- Re: Changing the Index values of a molecule (the differenece between gro and pdb files) (Wed Aug 15 2007 - 12:34:52 CDT)
- Re: nonstandard solvate + cyclic peptides in explicit DMSO box + gofr (Thu Jul 26 2007 - 07:41:24 CDT)
- Re: changing certain dihedral angles while keeping rest of molecule fixed (Wed Jun 06 2007 - 10:41:54 CDT)
- Re: changing certain dihedral angles while keeping rest of molecule fixed (Wed Jun 06 2007 - 09:24:18 CDT)
- Re: Assigning Color Codes for stress/force in .xyz trajectory files (Fri Feb 09 2007 - 10:48:49 CST)
- Re: Assigning Color Codes for stress/force in .xyz trajectory files (Fri Feb 09 2007 - 07:57:09 CST)
- Re: I have working PETE xbgf file, now how to combine into membrane? (Wed Dec 27 2006 - 13:21:27 CST)
- Re: Trying to Build a Membrane w/conical pore out of PET (polyethylene terephthalate) (Mon Dec 25 2006 - 11:38:07 CST)
- Re: Trying to Build a Membrane w/conical pore out of PET (polyethylene terephthalate) (Sat Dec 23 2006 - 01:02:19 CST)
- Re: Trying to Build a Membrane w/conical pore out of PET (polyethylene terephthalate) (Fri Dec 22 2006 - 13:19:24 CST)
- Re: VMD 1.8.5 installed. The graphics flashed and disappeared after installation. (Wed Dec 20 2006 - 10:08:49 CST)
- Re: VMD 1.8.5 installed. The graphics flashed and disappeared after installation. (Tue Dec 19 2006 - 13:30:20 CST)
- Re: generating psf file for a lipid: vmd looking for c-term and n-term ? (Tue Dec 05 2006 - 15:57:09 CST)
- Re: VMD-L: how to rotate the molecule so the long axis will be aligned to Z (Wed Apr 12 2006 - 12:16:30 CDT)
- Peter Hains
- Peter Hamm
- Peter Holm
- Peter Husen
- Peter Jensen Husen
- Peter Jones
- Peter Kroon
- Peter Lai
- Peter Mawanga
- Re: Decompose Transformation Matrix to Rotations and Translations along XYZ axes (Fri Mar 30 2018 - 12:51:59 CDT)
- Peter Monson
- Peter Murphy
- Peter Schellenberg
- Peter Schmidtke
- Peter Tieleman
- Peter van Heusden
- Peter Varnai
- peter.schellenberg_at_ipht-jena.de
- peter.schmidtke_at_fr.netgrs.com
- Peterson J
- Error during Water interaction data generation using gaussian following ffTK screencast (Wed Jul 10 2013 - 12:03:45 CDT)
- Re: namd-l: Re: Suggestions on parameterizing a ligand to simulate in NAMD (Thu Jun 13 2013 - 17:08:29 CDT)
- Re: namd-l: Re: Suggestions on parameterizing a ligand to simulate in NAMD (Thu Jun 13 2013 - 11:59:28 CDT)
- Re: namd-l: Re: Suggestions on parameterizing a ligand to simulate in NAMD (Tue May 21 2013 - 16:38:07 CDT)
- Re: namd-l: Re: Suggestions on parameterizing a ligand to simulate in NAMD (Tue May 21 2013 - 14:24:51 CDT)
- Re: namd-l: Re: Suggestions on parameterizing a ligand to simulate in NAMD (Tue May 21 2013 - 11:35:01 CDT)
- Petr Jerabek
- Petrica GASCA
- Petridis, Loukas
- Peyman Yamin
- Peyman Z.Moghadam
- Phelan Jr, Frederick R. Dr.
- RE: Is there any way to stop the display of bonds for bonded atoms on opposite sides of a periodic boundary without unwrapping? (Thu Mar 29 2012 - 15:32:59 CDT)
- Phelan Jr., Frederick R. Dr.
- Phelan Jr., Frederick R. Dr. (Fed)
- Philip Blood
- Philip Fowler
- Philip Loche
- Philip Peartree
- Philipp Schoen1
- Philipp Schn
- Increasing use of RAM even if I put unset/delete for selections! Due to use of arrays? (Tue Aug 14 2007 - 05:28:13 CDT)
- Philippe Bopp
- Re: Finding atoms in protein-lipid system having electrostatic interaction (Wed Aug 09 2017 - 15:14:56 CDT)
- Philippe Bopp / temporary
- Philippe Roche
- Phillip Compeau
- Phillips, Carolyn L.
- phoenix
- phubbard_at_post.its.mcw.edu
- Phuong Chau
- Pierpaolo Pravatto
- Pierre de Buyl
- Pieter van 't Hof
- Pietro Amodeo
- Re: MD very slow on a 8400M GS laptop (but not on a GT230M one) after NVidia driver update to 304.64 or 310.14 (Mon Nov 19 2012 - 20:18:27 CST)
- Re: MD very slow on a 8400M GS laptop (but not on a GT230M one) after NVidia driver update to 304.64 or 310.14 (Mon Nov 19 2012 - 14:03:38 CST)
- Re: MD very slow on a 8400M GS laptop (but not on a GT230M one) after NVidia driver update to 304.64 or 310.14 (Mon Nov 19 2012 - 12:58:26 CST)
- Re: MD very slow on a 8400M GS laptop (but not on a GT230M one) after NVidia driver update to 304.64 or 310.14 (Mon Nov 19 2012 - 10:25:33 CST)
- Typo in my previous e-mail subject. It's: "VMD" very slow on a 8400M GS laptop.... (Sat Nov 17 2012 - 02:18:12 CST)
- MD very slow on a 8400M GS laptop (but not on a GT230M one) after NVidia driver update to 304.64 or 310.14 (Fri Nov 16 2012 - 13:44:51 CST)
- Re: VMD-1.8.5: GLSL & NVidia troubles + fixed previous Spaceball problem (Sun Feb 11 2007 - 06:22:46 CST)
- VMD-1.8.5: GLSL & NVidia troubles + fixed previous Spaceball problem (Sat Feb 10 2007 - 05:59:42 CST)
- Pijush Ghosh
- Pilar Saiz Vela
- pinisetty dinesh
- Piotr Cieplak
- piriboy
- pkb bioinfo
- pkmukher
- pl
- plbrown_at_cs.duke.edu
- Pletezhov Alexandr
- poker_at_physics.usyd.edu.au
- Pol Garcia-Segura
- politr_at_huji.ac.il
- pontes_at_if.usp.br
- POTTER T.D.
- pouyan farzinpor
- prabhakar g
- Prabhakar Reddy Gudla
- Prabir Khatua
- prachi singh
- Praedor Atrebates
- Re: ???UNSURE??? Re: ???UNSURE??? Re: ???UNSURE??? Re: ???UNSURE??? Re: vmd crashes upon load of pdb (Fri Sep 23 2005 - 15:48:52 CDT)
- Re: ???UNSURE??? Re: ???UNSURE??? Re: ???UNSURE??? Re: vmd crashes upon load of pdb (Fri Sep 23 2005 - 15:24:51 CDT)
- pragya.saxena_at_research.iiit.ac.in
- prakhar gupta
- Pranjal Sur
- Prapti Lohi
- Prasad S Garimella
- Prashanth Athri
- Prateek Bansal
- prateeksha s
- Prathit Chatterjee
- Re: How to write a netcdf file in vmd from already loaded netcdf/dcd trajectory (Thu Dec 23 2021 - 09:08:51 CST)
- How to write a netcdf file in vmd from already loaded netcdf/dcd trajectory (Thu Dec 23 2021 - 05:00:44 CST)
- Re: Discrepancy in interaction energy of amber coordinate trajectories of a system (Fri Nov 20 2020 - 22:40:10 CST)
- Re: Discrepancy in interaction energy of amber coordinate trajectories of a system (Fri Nov 20 2020 - 04:49:42 CST)
- Re: Discrepancy in interaction energy of amber coordinate trajectories of a system (Mon Nov 09 2020 - 01:14:26 CST)
- Re: Discrepancy in interaction energy of amber coordinate trajectories of a system (Sun Nov 08 2020 - 21:55:55 CST)
- Re: Discrepancy in interaction energy of amber coordinate trajectories of a system (Sun Nov 08 2020 - 21:50:23 CST)
- Pratik Narain Srivastava
- Praveen Madala
- preeda
- PREETA DATTA
- preethi_at_bu.edu
- Prevost Martine
- Prithwish Nandi
- Priti Hansia
- PRITI ROY
- Priyabrata Panigrahi
- Priyanshu Gupta
- priyaranjini ranju
- priyodorshi satpati
- proclus_at_gnu-darwin.org
- Prof. Eddie
- psfgen on console missing dihedral parameters for standard residues (Tue Mar 09 2021 - 13:00:06 CST)
- Prof. Y. U. Sasidhar
- Projesh Roy
- Prskalo, Alen-Pilip
- AW: PhD position in Computational Structural Biology at MPI Muenster (Fri May 13 2011 - 06:26:56 CDT)
- puroorava annapaneni
- Puspita Halder
- pxq ѩ
- Pr Olsson
- q
- Q=96zer_Duman?=
- Q=A3ukasz_Pi=EAko=B6=22?=
- Q=C5=CC=C1=CC=CF=D7_=E9=CC=D8=D1?=
- q=CF=20=B3=C2?=
- q=E2=BA=E9=C3=F7?=
- Qasim Pars
- Qiang Fu
- Qiang Liu
- Qiao Baofu
- Qinghua Liao
- Qmer_AN?=
- QS=2E_Teletch=E9a=22?=
- quantrum75
- qun.ma_at_njit.edu
- qwang_at_mail.uh.edu
- r xu
- R. Charbel MAROUN
- R. Johnson
- R. M. Fesinmeyer
- R.Sathyapriya
- Raag Saluja
- Rabab Toubar
- Rabeta Yeasmin
- Re: How to fix the position of the lipid bilayer in the trajectories (Thu Mar 14 2019 - 12:33:01 CDT)
- Re: How to fix the position of the lipid bilayer in the trajectories (Thu Mar 14 2019 - 12:04:50 CDT)
- How to get 3D figure of solvent accessible surface area from APBS output (Fri Aug 11 2017 - 17:19:24 CDT)
- Re: Finding atoms in protein-lipid system having electrostatic interaction (Wed Aug 09 2017 - 15:22:53 CDT)
- Re: Finding atoms in protein-lipid system having electrostatic interaction (Wed Aug 09 2017 - 15:29:27 CDT)
- RABIUL ISLAM
- Rachel
- Rachel Ruskin
- Radak, Brian K
- radak004_at_umn.edu
- Rafael Bernardi
- Rafał Gąsior
- ragesh c
- Raghunadha Reddy Burri
- Rahul Mahajan
- Rahul Nikhar
- Rahul Sampath
- RAHUL SURESH
- Raik Grunberg
- Raik Gruenberg
- Rainer Fink
- rainy908
- rainy908_at_yahoo.com
- Raisa Carmen Andeme Ela
- Raj Gupta
- Rajahmundry Ganesh Kumar ch20d408
- rajan kumar
- Rajan Vatassery
- Rajat Chakraborty
- Rajesh
- Rajitha Tatikonda
- Rajorshi Chattopadhyay
- RAKESH
- Rakesh K
- Ralph Jimenez
- Raluca Mihaela ANDREI
- Ram Krishna Adhikari
- ram prasad via LinkedIn
- rama david
- Raman Parkesh
- Raman Preet Singh
- Ramasamy, Ellankavi
- Ramesh K. Sistla
- Ramesh Sistla
- Rameswar Bhattacharjee
- Ramie
- Ramin Ekhteiari
- ramin_ekh_at_REMOVE_yahoo.com
- Ramon Crehuet
- Ramon Garduno-Juarez
- Ramon Guixà
- Ramon Mendoza Uriarte
- Re: Why do the coordinates of my atoms change when writing to a pdb file? (Sun Mar 21 2021 - 15:58:22 CDT)
- Ramon Rocha
- rams rams
- Ramya Gamini
- Ramya Narasimhan
- Ran Friedman
- Ranabir Majumder
- Randall Hall
- Randell Lund
- Rangeen Othman
- Re: Problem with merging structures!( psfgen) Warning: failed to set coordinate for atom AU0 AU:1 A) (Thu Nov 27 2014 - 18:17:54 CST)
- Re: Problem with merging structures!( psfgen) Warning: failed to set coordinate for atom AU0 AU:1 A) (Thu Nov 27 2014 - 06:29:08 CST)
- Re: Problem with merging structures!( psfgen) Warning: failed to set coordinate for atom AU0 AU:1 A) (Wed Nov 26 2014 - 15:32:49 CST)
- Re: Problem with merging structures!( psfgen) Warning: failed to set coordinate for atom AU0 AU:1 A) (Wed Nov 26 2014 - 12:15:03 CST)
- Fwd: Problem with merging structures!( psfgen) Warning: failed to set coordinate for atom AU0 AU:1 A) (Wed Nov 26 2014 - 11:09:20 CST)
- Problem with merging structures!( psfgen) Warning: failed to set coordinate for atom AU0 AU:1 A) (Wed Nov 26 2014 - 09:36:57 CST)
- Ranyere Deyler
- Rasoul Nasiri
- rasti
- rasti_at_ut.ac.ir
- Rathinavelan, Thenmalarchelvi
- Raul Araya
- Raul Araya Secchi
- raunest
- Ravinder Abrol
- Raviteja Kurapati
- Ravithree Senanayake
- Rawan Al Nsour
- Ray, William
- Raymond C. Fort Jr.
- Raymond de Vries
- rebeca
- Rebeca Garca Fandio
- rebeca_at_mmb.pcb.ub.es
- Rebecca Alexander
- Rebecca Taylor
- Recep adyaman
- Regina Politi
- Reid Van Lehn
- Reinhard Klement
- Reinke.Patrick_at_mh-hannover.de
- Rejwan
- Remya Ann
- ren
- Renata KWIECIEN
- Rene
- Rene Prieto
- Rene Salmon
- René Genz
- René Hafner TUK
- Re: VMD Compilation with LEPTON & C++11 to support COLVARS "customFunction" WORKS now --- FLTK issue now (Sat Mar 06 2021 - 16:20:35 CST)
- Re: VMD Compilation with LEPTON & C++11 to support COLVARS "customFunction" WORKS now --- FLTK issue now (Sat Mar 06 2021 - 15:21:00 CST)
- Re: VMD Compilation with LEPTON & C++11 to support COLVARS "customFunction" WORKS now --- FLTK issue now (Sat Mar 06 2021 - 10:14:12 CST)
- Ren Genz
- Re: Fedora 20 x86_64 + ibus + sazanami fonts + GNOME => VMD 1.9.1 crashes (Mon Mar 10 2014 - 14:07:40 CDT)
- Research Jubilant
- Re: FATAL ERROR: UNKNOWN PARAMETER IN CHARMM PARAMETER FILE toppar_water_ions.str LINE=*set nat ?NATC* (Thu Apr 18 2013 - 13:03:53 CDT)
- Re: FATAL ERROR: UNKNOWN PARAMETER IN CHARMM PARAMETER FILE toppar_water_ions.str LINE=*set nat ?NATC* (Wed Apr 17 2013 - 18:48:41 CDT)
- Re: FATAL ERROR: UNKNOWN PARAMETER IN CHARMM PARAMETER FILE toppar_water_ions.str LINE=*set nat ?NATC* (Wed Apr 17 2013 - 16:54:08 CDT)
- Reuter Nathalie
- Revthi Sanker
- Rex Palmer
- Reza Esmaeeli
- Reza Khalkhali
- Reza Md.
- Reza Namakian
- Reza Salari
- Reza Shakouri
- reza vatan
- Ricard Argelaguet
- Ricardo Czekster
- Ricardo O. S. Soares
- Ricardo Oliveira dos Santos Soares
- Ricardo Soares
- Riccardo Innocenti Malini
- Rich Cook
- Re: Issues with flickering display using VMD 1.8.7 displaying over X11 to remote Mac (Thu Dec 17 2009 - 12:52:54 CST)
- Richard Wood
- Richard Casey
- Richard Cook
- Richard Daigle
- Richard Law
- Richard Overstreet
- Richard Stone
- Richard Swenson
- Richard Wood
- ridaka jannat
- Rima Chaudhuri
- Rinky Parakra
- Rita Cassia
- Ritu Arora
- riya doreen
- Rizal Sinaga
- Rob
- Re: vmd 1.8.7 on Intel 64 bit: segmentation fault (however: 1.8.6 works!) (Tue Dec 08 2009 - 01:03:29 CST)
- rob zehr
- Robabeh Moosavi
- robert
- robert austin
- Robert Brunner
- Robert Campbell
- Robert Chan-Jobe
- Robert Coridan
- Robert Dagil
- Robert Elder
- Robert Fenwick
- Robert fiske
- Robert Hoy
- Robert Johnson
- Re: Quick Surf Representation Getting Cutoff when Rendering with Tachyon (Tue May 29 2012 - 16:11:59 CDT)
- Robert Kretschmer
- Robert Matthew Fesinmeyer
- Robert Meklemburg
- Robert Milius
- Robert Mullen
- Robert Nairn
- Robert Selwyne
- Robert Wohlhueter
- Roberto Gaspari
- Roberto Guerra
- Robin Betz
- Robin Bush
- Robin L Hayes
- Robin Varghese
- Robison, Keith
- Rocchia Walter
- rocfo
- rodolfo gonzalez
- Rodolfo Pereyra
- Rodrigo Silveira
- Roessler, Bryan C
- Rogan Carr
- Roger A Larson
- Roger Nadler
- Rogers Swai
- Rohan Mehta
- rohan uttarwar
- Rohit Goswami
- Roland Schmucki
- Roland Schulz
- Rolando Carlson
- Roman Petrenko
- Roman Shevchuk
- Romaric David
- Ronald Cohen
- Ronald Salesky
- Roni Saiba
- Ronit Sarangi
- RonitS Chem
- root
- Roozbeh
- Ropon-Palacios G.
- ROPÓN-PALACIOS G.
- ROPÓN-PALACIOS G. G.
- Ropón-Palacios G.
- ROPN-PALACIOS G. G.
- Rosanne Zeiler
- Rose, Stuart Wallace
- Roshan Shrestha
- Roshan Tasgaonkar
- Ross Gunderson
- Ross J. Toedte
- Ross Williams
- rossi_at_york.cuny.edu
- Royce Rosa
- rschurhammer_at_chimie.u-strasbg.fr
- Rubner, Oliver
- Ruchi Sachdeva
- Rudesh Toofanny
- Rudra Banerjee
- Rudy Puckett
- Rudy Richardson
- Re: Running VMD 1.9.4alpha on newer GPUs that require CUDA 11+ and OptiX 7+ (Wed Feb 01 2023 - 15:59:36 CST)
- Ruggero Cortini
- Ruijie Darius Teo
- Re: Couldn't read internal coordinate table and list index out of range (Tue Feb 23 2021 - 20:23:57 CST)
- ruiyan
- Rukman Hertadi
- Runak R
- Rune Thomas Kidmose
- Sv: problem with mol IDs when running script from same VMD session. (Sun Jun 03 2018 - 14:33:45 CDT)
- Rupashree Shyama Ray
- Russell Poyner
- Russell, John Thomas
- rwiese_at_unr.edu
- Ryan Golhar
- Ryan Hoffman
- Ryan McGreevy
- Re: MDFF through VMD Error FATAL ERROR: DIDN'T FIND vdW PARAMETER FOR ATOM TYPE OT (Fri Dec 21 2018 - 10:44:42 CST)
- Re: problem with mol IDs when running script from same VMD session. (Sun Jun 03 2018 - 14:40:31 CDT)
- Ryan P Steele
- Ryan P. Steele
- Ryan Pavlovicz
- Ryan Woltz
- Re: pbc box unwrapping/wrapping error infinite bond angles/box sides (Mon Aug 12 2024 - 14:42:56 CDT)
- s lal badshah
- S. Jamal Rahi
- S.G.Falkovich
- s.hogg_at_ic.ac.uk
- S.K. Ghosh
- s.schweizer_at_dkfz-heidelberg.de
- s104fendy
- saam
- Sabine Leroch
- Sabine Reisser
- Sabuj Pattanayek
- Re: console in vmd-1.8.3 amd64 is blank (like white text on white background) so I can't see any output messages (Thu Apr 21 2005 - 17:46:59 CDT)
- Re: console in vmd-1.8.3 amd64 is blank (like white text on white background) so I can't see any output messages (Thu Apr 21 2005 - 17:32:55 CDT)
- console in vmd-1.8.3 amd64 is blank (like white text on white background) so I can't see any output messages (Thu Apr 21 2005 - 17:19:57 CDT)
- Re: vmd and Re: [PyMOL] pymol crashes with new [7167] nvidia driver (Tue Mar 29 2005 - 11:55:03 CST)
- Re: vmd and Re: [PyMOL] pymol crashes with new [7167] nvidia driver (Tue Mar 29 2005 - 11:11:54 CST)
- Re: vmd and Re: [PyMOL] pymol crashes with new [7167] nvidia driver (Sat Mar 26 2005 - 16:45:31 CST)
- Re: nvidia quadro, linux_x86, and performance difference w/nvidia drivers 1.0.5336 vs anything newer or older on VMD 1.8.2 (Tue Jan 04 2005 - 18:17:30 CST)
- Sacerdoti, Federico
- Sachin Natesh
- Sadegh Faramarzi Ganjabad
- sadia tanweer
- saeed
- saeed amini
- SaeeD PourasaD
- safron saif
- Sahithya Iyer
- Sahu, Subin
- Saikat Pal
- Sajad Ahrari
- sajad falsafi
- Re: how do I show contacts with XXX angstroms between a protein and a ligand? (Tue Jun 07 2011 - 04:55:18 CDT)
- Fw: how do I show contacts with XXX angstroms between a protein and a ligand? (Sun Jun 05 2011 - 08:06:56 CDT)
- Sajeewa Pemasinghe
- Saketh Bharadwaja
- Sakinah Ellickson
- Saladino, Alex
- Sale, Kenneth L
- sally cii
- Sally Fisher
- Salomon Turgman Cohen
- Salvador H-V
- Salvatore Guccione
- Salvatore Mario Cosseddu
- Re: Create multiple tcl interpreter child instances within VMD to run several scripts at once (Thu Feb 16 2012 - 12:04:17 CST)
- Re: Create multiple tcl interpreter child instances within VMD to run several scripts at once (Thu Feb 16 2012 - 11:49:55 CST)
- Sam Ansari
- Sam Fredrick
- Sam Wallace
- Script to impose coordinates from separate file onto equivalent selection of atoms (Thu Mar 26 2015 - 07:21:43 CDT)
- Re: Possible handle leak in 'measure gofr' VMD 1.9.1 Windows (no cuda) (Fri Sep 21 2012 - 19:14:00 CDT)
- Re: Possible handle leak in 'measure gofr' VMD 1.9.1 Windows (no cuda) (Tue Aug 28 2012 - 00:54:21 CDT)
- Re: Possible handle leak in 'measure gofr' VMD 1.9.1 Windows (no cuda) (Sun Aug 26 2012 - 21:27:07 CDT)
- Re: Possible handle leak in 'measure gofr' VMD 1.9.1 Windows (no cuda) (Sun Aug 26 2012 - 09:33:24 CDT)
- Re: Possible handle leak in 'measure gofr' VMD 1.9.1 Windows (no cuda) (Sun Aug 26 2012 - 09:02:36 CDT)
- Re: Adding an atom to existing trajectory (to enable RDF from centre of mass of a selection) (Sun Nov 13 2011 - 04:58:37 CST)
- Samapika Sahu (P20CY011)
- Samartha G. Anekal
- Samir Unni
- Sampath, Janani
- Sampo Karkola
- Samuel Bowerman
- Samuel C Flores
- Samuel Canner
- Samuel Coulbourn Flores
- Samuel Coulbourn Flores 花山
- Samuel Flores
- Samuel Jobbins
- Fw: Fw: Colour coordinating atoms in a trajectory by Coordination Number (Mon Mar 30 2015 - 11:28:54 CDT)
- Samuel Schlachter
- Samuele Salis
- Samy Hamdouche
- san kumar
- Sandeep Gupta
- Sandeep Kumar Reddy
- Sandeep Prakash
- Sandip Mondal
- Sandra Bennun Serrano
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- Sandro Canavezzi de Abreu
- Sandy Anderson
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- Sanghyun Park
- Sangita Kachhap
- Sangkha Borah
- Sangwoo Shim
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- Sanjay Kumar Paul
- Sanjeev
- Sanjeev B.S.
- sanjeev_at_mbu.iisc.ernet.in
- Sanjib Chowdhury
- sankari thirumal
- Santanu Chatterjee
- Santanu Santra
- Santhosh Ranga
- santhu kumar
- SAPAY Nicolas 232321
- Sara baretller
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- sarah k
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- Sarah Richards
- saravana prakash
- Sardiu, Mihaela (NIH/NLM/NCBI)
- Sarfraz Ahmad
- Sarthak Mohanty
- Sascha Tayefeh
- Sasha Buzko
- Sasha Perkins
- Sasthi Charan Mandal
- Sathyapriya R
- satya kumar
- Satyaki Chatterjee
- Satyan Sharma
- Satyavani Vemparala
- Saumik Sen
- Saumyak Mukherjee
- Saurav Goel
- Scazzocchio, Claudio
- Schmidt, Mike
- Schreiner Eduard
- schwarz
- schwarz_at_titus.u-strasbg.fr
- SciFarma
- SCIPIONI Roberto
- scopio
- Scott Pendley
- Scott Stagg
- Scott Thibault
- Scott W. Sides
- Sean Seyler
- Sean T Kigerl
- Sebastian Maximilian Wilhelm
- Sebastian Reiter
- Sebastian Schneider
- Sebastian Stolzenberg
- Solvate Plugin: Why "Rotate to minimize volume" along 2 instead of 3 axes? (Mon Sep 22 2014 - 10:22:13 CDT)
- Solvate Plugin: Why "Rotate to minimize volume" along 2 instead of 3 axes? (Mon Sep 22 2014 - 09:59:35 CDT)
- Sebastian Wilhelm
- Sebastián Gutiérrez
- Sebastin Gutirrez
- seda demirci
- Seera Suryanarayana
- How to keep particular water molecules within the cut off during the simulations (Wed Jan 20 2021 - 23:15:37 CST)
- how to find phi-psi angles of residue of our interest in NMR structure? (Wed Mar 30 2016 - 04:23:17 CDT)
- Sefcikova, Jana
- RE: restarting calculations anytime within Equilibration and MD simulations steps in QwikMD (Tue Apr 30 2024 - 17:41:39 CDT)
- Seibold, Stephen
- Seibold, Steve Allan
- Seiichiro Tanizaki
- Sekwan Oh
- Semeraro, B David
- Semorale
- SENTHIL KUMAR
- Seojin You
- SeongJun Heo
- Sergei Izrailev
- Sergey Ivanov
- Sergey Krishtal
- Sergey Mkrtchyan
- Sergey Samsonov
- Sergio
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- Sergio Decherchi
- Sergio E. Wong
- Sergio Garay
- Sergio Perez
- Sergio Urahata
- sesha surya vara prasad reddy karri
- Seth Axen
- Seth Burleigh
- Seth Tanner
- setyanto md
- Seungho Choe
- Seweryn Bialasiewicz
- SEZEN VATANSEVER
- sfrickenhaus
- Shachi Gosavi
- Shadi Mirzae
- Shah, Tanooj
- SHAHEE ISLAM
- Shaherin Basith
- Shahid Qamar
- Shailesh Pandey
- Shalabh Maroo
- Shane O Mahony
- Shane.OMahony
- Shang,Emily
- Shangmin Xiong
- Shantenu Jha
- Shantipriya Tenneti
- Shaojie Ma
- Shaorui Yang
- Sharav Desai
- Shari Chin
- Sharlene Denos
- Shashank Ranjan Srivastava
- Shashidhar Rao
- Shatadal Ghosh
- Shawn
- Shay Amram
- Shayna Hilburg
- Sheena Singh
- Shehan Parmar
- sheikh sameer
- Sheldon Park
- sheldonp_at_sas.upenn.edu
- Shen
- Sheng, Zi-Zhang
- Shenoy, Sukesh
- Sherif Arafa
- Sherman Sherman
- Shesh Nath
- shgnwgn_at_eden.rutgers.edu
- Shi, Chuanyin
- shiladitya_at_jncasr.ac.in
- Re: trouble with running vmd after installation , machine gets hung (Mon Sep 22 2008 - 18:45:30 CDT)
- Shilpa Gupta
- Shirin
- Shirin Awasthi
- Shirley Hui
- Shirley Li
- Re: Re: to load multiple trajectory files/append dcd to a PSF file? (Tue Aug 10 2004 - 13:50:12 CDT)
- SHIVAM TIWARI
- Shivanand Malaganvi
- Shivang Agarwal
- shixin yang
- shiyong liu
- shiziyuan
- shome sankar bhunia
- Shomesankar Bhunia
- Shore, Jay
- Shoresh Shafei
- Shounak Mukherjee
- shourabh rawat
- SHRAVANI NETHI
- SHRAVANI NETHI .
- Shuaib Shahid
- Shubhadip Das
- Shubham Agarwal
- Shubham Mishra
- Shubhangi Gupta
- Shulin Zhuang
- Shuo Li
- Shyam Saladi
- shyam sharma
- shyama Prasad rao
- shyamala
- Shyno Mathew
- Sibel Cakan
- Sichun Yang
- siddesh southekal
- Siddharth Girdhar
- Siddharth Subramanian
- Sidra Rafi
- Siegmar Kardinal
- Siew Wen Leong
- siladitya mukherjee
- Re: information regarding tcl script for cell volume changing with each frame (Sat Mar 03 2012 - 16:18:07 CST)
- Siladitya Padhi
- Silvina Matysiak
- silvya
- simao.pereira_at_di3.units.it
- Simon Dürr
- Re: Selecting atoms of same type in a certain distance (between X and Y angstroms away) (Wed Jun 22 2016 - 08:58:28 CDT)
- Simon Etter
- Simon Hogg
- Simon Latapie
- simon stockes
- Simon Su
- Simon Wheeler
- simon whitehead
- Simone Gargano
- Simone Lorenzi
- Simone Melchionna
- Simpson, Lisa M
- Simulation Biology
- Sina Zarepakzad
- Sinan Arslan
- Sinclair, Matt
- Reminder: Hands-On Workshop on Computational Biophysics in Auburn, AL (Mon Aug 12 2024 - 13:10:07 CDT)
- Sindrila Dutta Banik
- Siyoung Kim
- sjcav_at_aros.net
- SKM
- skolev_at_mnet.bg
- Sladjana Maric
- SM Bargeen A Turzo
- SMAHANE CHALABI
- Smith, Harper
- Smith, Harper E.
- Smolin, Nikolai
- Snehasis Chatterjee
- snoze pa
- Soeren von Buelow
- Sofya Lushchekina
- Solen
- sollebac
- Somnath Dutta
- SONAL GAHLAWAT
- Sonibare, Kolawole
- Sonja M. Schwarzl
- SONY kaur
- soodabeh ghaffari
- sooraj achar
- Sophia Hirakis
- Sophie Mader
- soroush ziaei
- soumadwip ghosh
- Soumik Ghosh
- Soumya Lipsa Rath
- soumyajyoti haldar
- Sourav Pal
- Sourav Ray
- Re: Coarse-graining: Inability to assign charge to C-terminus using fix_martini_psf.tcl (Mon Dec 14 2015 - 18:22:50 CST)
- Coarse-graining: Inability to assign charge to C-terminus using fix_martini_psf.tcl (Mon Dec 14 2015 - 17:51:46 CST)
- Re: Fwd: Inviting applications for a new PhD program in Quantitative Biosciences at Georgia Tech (Wed Sep 09 2015 - 22:51:54 CDT)
- Re: namd-l: Announcement: 'Hands On' Workshop on Computational Biophysics (Berkeley, CA, Aug 3-7, 2015) (Wed May 20 2015 - 00:33:00 CDT)
- Re: Putting different peptide chains (spaced apart) in a single .xbgf file (Mon Feb 09 2015 - 02:28:54 CST)
- Sourmaidou, Damiani
- Souvik Sinha
- spandu K
- sperez14_at_us.es
- spezia_at_caspur.it
- Spitaleri Andrea
- spitaleri.andrea_at_hsr.it
- Sridhar Acharya
- Srikanth Dhondi
- srikasi.qut_at_gmail.com
- srinivasa murthy
- Srinivasan Madabushi
- sriteja mantha
- srtlscao
- Sruthi Sudhakar
- ssaurabh_at_physics.iisc.ernet.in
- sseefeld_at_uwm.edu
- sstappa_at_uwm.edu
- St. John, Alexander V. (MU-Student)
- Stamatia Zavitsanou
- Stanislav Polonsky
- Re: Problem: volumetric data coloring fails on AIX5_64 with GXT6500 OpenGL renderer (Thu Jul 23 2009 - 16:42:37 CDT)
- Re: Problem: volumetric data coloring fails on AIX5_64 with GXT6500 OpenGL renderer (Thu Jul 23 2009 - 12:21:14 CDT)
- Re: Problem: volumetric data coloring fails on AIX5_64 with GXT6500 OpenGL renderer (Thu Jul 23 2009 - 10:39:36 CDT)
- Re: Problem: volumetric data coloring fails on AIX5_64 with GXT6500 OpenGL renderer (Mon Jul 20 2009 - 16:19:05 CDT)
- Re: Problem: volumetric data coloring fails on AIX5_64 with GXT6500 OpenGL renderer (Mon Jul 20 2009 - 13:16:31 CDT)
- Stanislaw Bobritsky
- Stanley Lan
- Stanley, Yemin Shi
- Statics Eng
- Stef
- Stefan Boresch
- Stefan Doerr
- Re: How to copy/paste a membrane patch to create a larger membrane? (Mon Feb 05 2018 - 09:10:55 CST)
- Stefan Franzen
- Stefan Gerlach
- Stefan Grzybek
- Stefan Ivanov
- Stefan Kuczera
- Stefan Lyne Oliver
- Stefan Oliver
- Stefano Guglielmo
- Stefano Meliga
- Stefano Piana
- stefano ricagno
- Stefano Ugolini
- stefdoerr_at_gmail.com
- Steinar Halldorsson
- Stephan Frickenhaus
- Stephan Grein
- Stephane
- stephane acoca
- Stephane Spieser
- Stephani Macalino
- Stephanie Held
- Stephanie Teich-McGoldrick
- Stephen Cox
- Stephen Dutz
- Stephen Herbein
- Stephen Hicks
- Stephen Koch
- Stephen M. Dutz
- Stephen Montgomery-Smith
- Stephen P. Molar, Ph.D.
- Stephen P. Molnar, Ph.D.
- Stephen Thomas
- Stephen Walch
- Sterling Paramore
- Stern, Julie
- Steve Chen
- Steve Ding
- Steve Jensen
- Steve Massard
- Steve Seibold
- Steve Smith
- steve_at_beefeater.darkorb.net
- Steven Cohen
- Steven De Volder
- Steven F. Killen
- Steven Neumann
- Steven S Plotkin
- Steven W
- Steven Wang
- Steven(Yuhang) Wang
- Stewart Dickson
- sting
- sting
- Stipe Mustać
- Stober, Spencer T
- Stock, Mark
- Stojanoski, Vlatko
- Storr, Mark
- Strahs, Dr. Daniel Bernard
- Two questions: reordering molecule IDs and deleting frames with TCL commands (Sat Mar 11 2023 - 17:03:09 CST)
- Streiff, John H.
- Streutker, J
- Stuart Murdock
- studier_at_life.illinois.edu
- Stphane
- Stphane Pezennec
- Stphane Teletcha
- Re: High CPU usage with vmd-1.8.4b6 (99.9 %CPU ...) while using the FPS indicator (Tue Jan 10 2006 - 10:08:22 CST)
- Stphane Tletcha
- Subbarao Kanchi
- Re: regarding the coordinate transformation on a curved surface to plane surface (Wed Jan 09 2019 - 02:30:46 CST)
- Subbusinger N
- Subha Kalyaanamoorthy
- subhasish chatterjee
- Subhasish Mallick
- Subramanian Vaitheeswaran
- subramanian vidhyasankar
- Subrata Paul
- Suchetana Gupta
- Suckjoon JUN
- Sudipta Sinha
- Sue Legge
- Sujata Roy
- Sujata Sovani
- Rotating and saving coordinates of a copy of molecule alongwith original molecule (Thu Mar 31 2011 - 13:18:54 CDT)
- Suleman Ansari (P19PH004)
- Suman Chakrabarty
- Sumit Kumar
- sumit nagar
- Sun Yicheng
- Sunando Datta
- Sundararajan Natarajan
- Sung M Hong
- Sunidhi IIITD
- Sunidhi Lenka
- Sunita Patel
- Sunjoo Lee
- sunnytov
- sunyeping
- Re: Re: vmd cannot display part of the protein in gromacs gro/trr file format (Sat Feb 11 2017 - 07:23:39 CST)
- Re: vmd cannot display part of the protein in gromacs gro/trr file format (Sun Feb 05 2017 - 08:16:49 CST)
- vmd cannot display part of the protein in gromacs gro/trr file format (Fri Feb 03 2017 - 02:44:20 CST)
- Re: chain identifier change in the pdb files generated by the "solvate" and "Add Ions" plugin (Mon Oct 10 2016 - 21:04:45 CDT)
- chain identifier change in the pdb files generated by the "solvate" and "Add Ions" plugin (Mon Sep 26 2016 - 21:46:54 CDT)
- how to change the color of all the C atoms in the newly created copy of representation (Fri Aug 19 2016 - 07:54:55 CDT)
- how to explore the frame number in clustering analysis by the clustering plugin (Thu Jul 07 2016 - 03:54:16 CDT)
- what is difference between "TOTAL", “TOTAL2" and "POTENTIAL" in the VMD plugin NAMD Plot? (Mon Nov 09 2015 - 02:22:23 CST)
- Why the 4ake-target_autopsf.situs can not be generated in MDFF tutorial? (Mon May 11 2015 - 02:33:43 CDT)
- show water around a residue for all the frames of the MD trajectory (Sat Jan 03 2015 - 09:13:16 CST)
- RE: a script to count the frames in which some water molecules interact with selected protein atoms (Tue Dec 30 2014 - 19:13:35 CST)
- Super Sayan
- superdirac
- surendra jain
- Surendra Kumar Jain
- Surendra Negi
- Suresh
- Suresh Ghimire
- Surjit Dixit
- surya narayanan
- surya narayanan chandrasekaran
- Susan Langston
- Susana Tomasio
- Re: Linkage problem when compiling fortran bindings for VMD molfile plugins (Fri Mar 18 2011 - 11:21:56 CDT)
- Re: Linkage problem when compiling fortran bindings for VMD molfile plugins (Fri Mar 18 2011 - 08:55:33 CDT)
- Re: Linkage problem when compiling fortran bindings for VMD molfile plugins (Mon Mar 14 2011 - 16:49:11 CDT)
- Re: Linkage problem when compiling fortran bindings for VMD molfile plugins (Mon Mar 14 2011 - 16:04:51 CDT)
- Susanna Crowe
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- suzie.k.hight.1
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- SYEDA SABIHA SULTANA LUBNA .
- Sylvain EDALEINE
- syma
- Syma Khalid
- Sze May Yee
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- T K
- T Luchko
- T. Chyau Liang, Ph.D.
- t.shivam_at_iitg.ernet.in
- Tabris Chun Chan
- Taco de Wolff
- TAE BUM LEE
- Taeho Kim
- taeho.kim_at_utoronto.ca
- Tahmina Akter
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- Takeru KAMEDA
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- Tamara Rogers
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- Tatyana I. Igumenova
- Tatyana Kuznetsova
- Tatyana Sysoeva
- tatyana_at_fi.uib.no
- tatyanasysoeva_at_gmail.com
- Taufik Al-Sarraj
- Tauna Rignall
- Tawhid Ezaz
- TCBG Workshop
- TCBG Workshops
- tcickovs_at_nd.edu
- tclick_at_nctu.edu.tw
- Teich-McGoldrick, Stephanie
- Teletcha Stphane
- Terry Jordan
- Tessa Young
- THANH NGUYEN
- ThatMind TV
- The Cromicus Productions
- Re: [VMD-NAMD] Question about Dipole of DNA / Dipole Moment Watcher Plugin (Sun Mar 25 2018 - 20:31:45 CDT)
- The Post Office
- theblueone_at_web.de
- thereal sisterdot
- Thereza Soares
- thiagorrg UFC
- Thiau Fu Ang
- Thibault TUBIANA
- Thierry Oscar Wambo
- thiru pathi
- Thomas Albers
- Thomas Aldershof
- Thomas Bishop
- Thomas C Bishop
- Thomas C. Bishop
- Re: Python script to fix autoionize issues related to long atom type names (Wed Jun 27 2012 - 08:24:30 CDT)
- Re: gui RMSD vs text RMSD calcs differ b/c ddiff backbone atom definitions (Mon Nov 19 2007 - 10:27:02 CST)
- Thomas Caulfield
- Thomas Christott
- Thomas Ehmer
- Thomas Evangelidis
- Re: how to measure the distance of two atoms in 1000 conformations? (Mon Nov 19 2012 - 09:04:07 CST)
- Re: VMD (and NAMD) fail to read simple AMBER prmtop file (and it's not the SCEE and SCNB flags) (Mon Oct 22 2012 - 06:15:49 CDT)
- Re: how to set color parameters differently for different molecules (Thu Jan 29 2009 - 19:08:08 CST)
- Re: how to set color parameters differently for different molecules (Thu Jan 29 2009 - 15:34:31 CST)
- Thomas Freeman
- Thomas Griffiths
- Thomas Hedegaard Pedersen
- Thomas Lemmin
- Thomas Schmidt
- Thomas Sexton
- Thomas Sommerfeld
- Thomas Steinbrecher
- Thomas Zauner
- ThuZar Lwin
- Thyagarajan, Raghuram
- tiago sobreira
- Tianhua Feng
- Tibbitt, Jeffrey A.
- Tiglath Moradkhan
- Tim Carpenter
- Tim Freeman
- Tim Isgro
- Tim Lo
- Re: Shifting the Geometric Center of entire set of molecules to origin (Fri Nov 06 2015 - 22:38:19 CST)
- Re: Fwd: namd-l: Why RDF increases as r increase instead of constant (Tue Nov 04 2014 - 20:48:32 CST)
- Tim Meyer
- Tim Moore
- Tim Skirvin
- Tim Travers
- Tim Werner
- Timm Essigke
- Timothy Click
- Timothy Driscoll
- Timothy Leong
- Timothy W Suen
- Ting Wang
- tinifcarter_at_gmail.com
- TIS SARL
- Tisha Engle
- tiziano gallo cassarino
- Tjaart de Beer
- tnels_at_sfu.ca
- Tobias Mandrup Johansen
- Todd J. Furlong
- Tolga Akiner
- tolga.akiner
- Tom
- Tom Bartl
- Tom Haxton
- tom keyes
- Tom King
- Tom Pollard
- Tom.Verhelst_at_ucb.com
- Tomek Wlodarski
- Tommy Wang
- Tomo Hayashi
- Toni Giorgino
- Tony Myung Keun Cho
- Tony Sheh
- Torsten Kerber
- Tory Mohr
- toshiaki.tomimori_at_uniadex.co.jp
- Traci Clymer
- Tran Trung Tran
- Tran, Tran
- Travis DePuy
- Travis Meyer
- Trifan, Anda
- TRINH Minh Hieu
- Trinh Vo
- Tripathi, Ashutosh
- tripp_at_fis.unam.mx
- Tristan Bereau
- Tristan Croll
- Re: Re: -fpascal-strings flag when compiling with TDCONNEXION option (Wed Jan 13 2016 - 13:31:47 CST)
- Re: can I change the axes type to look like something like a graduated coordinate? (Sun Nov 08 2015 - 19:33:17 CST)
- Re: Shifting the Geometric Center of entire set of molecules to origin (Wed Nov 04 2015 - 05:38:44 CST)
- Re: Putting different peptide chains (spaced apart) in a single .xbgf file (Sun Feb 08 2015 - 19:30:28 CST)
- Re: Putting different peptide chains (spaced apart) in a single .xbgf file (Sun Feb 08 2015 - 14:57:01 CST)
- RE: Problem with merging structures!( psfgen) Warning: failed to set coordinate for atom AU0 AU:1 A) (Wed Nov 26 2014 - 16:43:36 CST)
- Re: Feature request: capturing tool location and steering forces in IMD trajectory (Fri May 16 2014 - 16:27:01 CDT)
- Re: Feature request: capturing tool location and steering forces in IMD trajectory (Mon Apr 07 2014 - 03:29:31 CDT)
- Feature request: capturing tool location and steering forces in IMD trajectory (Mon Apr 07 2014 - 00:45:51 CDT)
- RE: AW: TCL scripting question: how to make a list of atomselections persistent? (Fri Mar 28 2014 - 23:19:50 CDT)
- Re: AW: TCL scripting question: how to make a list of atomselections persistent? (Fri Mar 28 2014 - 03:45:22 CDT)
- TCL scripting question: how to make a list of atomselections persistent? (Thu Mar 27 2014 - 19:04:22 CDT)
- Generalisation of chirality plugin to handle chiral bonds spanning residues (Wed Mar 05 2014 - 05:48:46 CST)
- RE: FATAL ERROR: UNABLE TO FIND DIHEDRAL PARAMETERS FOR NH3 CT1 CT2A CT2 (ATOMS 1 5 7 10) (Fri Jan 24 2014 - 02:49:22 CST)
- RE: Re: VRPN driver for Novint Falcon haptic device available - Looking for Testers (Fri Aug 16 2013 - 06:41:17 CDT)
- RE: How can I easily show ball and stick residues across all molecules and representations? (Thu Jul 18 2013 - 20:18:40 CDT)
- RE: Re: VRPN driver for Novint Falcon haptic device available - Looking for Testers (Wed Jul 03 2013 - 23:32:06 CDT)
- RE: secondary structure works on linux, it doesn't work on Mac in certain structures (Wed Jul 03 2013 - 23:50:03 CDT)
- RE: Re: VRPN driver for Novint Falcon haptic device available - Looking for Testers (Wed Jul 03 2013 - 23:46:50 CDT)
- Trollmann, Marius
- Troy Wymore
- Tru Huynh
- Re: Re: VMD 1.9.1 core dumps (CentOS-5 x86_64) nvidia drivers: 304.64/4x GTX 680 (Thu Dec 13 2012 - 11:41:46 CST)
- Re: Re: VMD 1.9.1 core dumps (CentOS-5 x86_64) nvidia drivers: 304.64/4x GTX 680 (Tue Dec 11 2012 - 05:10:38 CST)
- Re: Re: VMD 1.9.1 core dumps (CentOS-5 x86_64) nvidia drivers: 304.64/4x GTX 680 (Mon Dec 10 2012 - 16:58:57 CST)
- Re: VMD 1.9.1 core dumps (CentOS-5 x86_64) nvidia drivers: 304.64/4x GTX 680 (Mon Dec 10 2012 - 15:46:45 CST)
- Re: Re: VMD 1.9.1 core dumps (CentOS-5 x86_64) nvidia drivers: 304.64/4x GTX 680 (Mon Dec 10 2012 - 14:11:53 CST)
- VMD 1.9.1 core dumps (CentOS-5 x86_64) nvidia drivers: 304.64/4x GTX 680 (Mon Dec 10 2012 - 09:14:43 CST)
- Re: VMD 1.9.1 core dumps (CentOS-5 x86_64) nvidia drivers: 304.64/4x GTX 680 (Mon Dec 10 2012 - 09:19:55 CST)
- Re: vmd-1.8.7 building from source ->few plugins "package could not be loaded" (Wed Dec 09 2009 - 13:53:18 CST)
- Re: vmd-1.8.7 building from source ->few plugins "package could not be loaded" (Wed Dec 09 2009 - 13:37:45 CST)
- Re: vmd-1.8.7 building from source ->few plugins "package could not be loaded" (Tue Dec 08 2009 - 14:22:23 CST)
- Truc Kim
- Trung Nguyen Duc
- tscheng_at_ic.sunysb.edu
- tsirk
- Tsu-Fan Cheng
- Tu.Le_at_csiro.au
- TUBIANA Thibault CNRS
- Turgay Cakmak
- Turman, Cheri M
- Tvedt, Nathan
- Tye Dwight Martin
- Tyler Heibeck
- Tyler Luchko
- Tyler Smith
- Tyler Westland
- tyrrell t
- TZU-LAN YEH
- Tre Han Balta
- Uday Chippada
- Uday K. Chippada
- Udaya Dahal
- Udeshini Manatunga
- Udit Aswal
- udit0000_at_gmail.com
- Ugur Akgun
- Umesh Ghoshdastider
- Umut Gerlevik
- unni kuttan
- Upadhyay, Him [him.upadhyay_at_ndsu.edu]
- Upamanyu Ray
- upayan baul
- Urahata
- Urquhart, Stephen
- Urszula Uciechowska
- Ushasi Pramanik 1710228
- utku.ozkan_at_bilkent.edu.tr
- Utpal Sarkar
- uu zhu
- V. Kumar
- v.satarifard
- Vadim Patsalo
- Vahdati N.
- Vaidehi Doke
- Vaidyanathan Sethuraman
- Re: Topotools guessing angle and bond topology from CONNECT info in PDB files (Thu Nov 23 2017 - 02:15:32 CST)
- Valentin Gogonea
- Re: Molefacture does not write bond angles and dihedral angles info in the psf file (Thu Jul 23 2020 - 17:13:01 CDT)
- Molefacture does not write bond angles and dihedral angles info in the psf file (Thu Jul 23 2020 - 16:10:38 CDT)
- Valentina Erastova
- Valere Chen
- Valeria Molinero
- valeria.losasso_at_stfc.ac.uk
- Valerio Sorichetti
- Valodymyr Nechyporuk-Zloy
- Vamsee Voora
- VandeVondele Joost
- vaneeta bala
- Vani Krishna
- vani panguluri
- Vani Vemparala
- Vardan Vardanyan
- Re: fftk, ORCA, Bond and Angle Optimization, error As a subsequent Frequencies calculation has been requested (Thu Aug 15 2024 - 11:11:19 CDT)
- varsha gautham
- varun dewaker
- Vasiliy S. Znamenskiy
- Vasiliy Triandafilidi
- Vasista
- Vasumathi Velachi
- Venkata Mandala
- venkataraman kabaleeswaran
- Vermaas, Josh
- Re: pbc box unwrapping/wrapping error infinite bond angles/box sides (Mon Aug 12 2024 - 09:42:09 CDT)
- Re: compile vmd-1.9.4a57 source - OptiXRenderer.h:84:10: fatal error: optix_math.h: No such file or directory (Fri Jul 26 2024 - 10:21:01 CDT)
- Re: Working with trajectory and updating frames dependents on current frame (Thu Jul 18 2024 - 15:56:01 CDT)
- Re: looking for help to solve FATAL ERROR: Didn't find vdw parameter for atom type C11 (Wed Mar 06 2024 - 09:36:55 CST)
- Re: ffTK Opt. Charge Run Optimization Error PSF File Problem INQUIRY (Mon Feb 05 2024 - 09:25:25 CST)
- Re: Viewing Van der Waals bonds of a protein ligand in complex inquiry (Mon Sep 11 2023 - 09:00:34 CDT)
- Re: Fwd: Problem building vmd with ospray - OSPRayRenderer.h error: ‘OSPModel’ does not name a typ (Fri Feb 24 2023 - 00:19:28 CST)
- Re: Running VMD 1.9.4alpha on newer GPUs that require CUDA 11+ and OptiX 7+ (Wed Feb 01 2023 - 08:23:56 CST)
- Re: Running VMD 1.9.4alpha on newer GPUs that require CUDA 11+ and OptiX 7+ (Tue Jan 31 2023 - 14:04:57 CST)
- Re: Problem with measure bond command returning -NaN for some frames (Mon Aug 29 2022 - 08:49:37 CDT)
- Re: Unable to useTachyon-Optix renderer when VMD is installed in Windows Subsystem for Linux (WSL) (Wed Jun 08 2022 - 08:23:15 CDT)
- Re: VMD 1.9.4 crashes after running the "Merge Structures" plugin (with psfgen 2.0) (Wed Apr 06 2022 - 08:04:56 CDT)
- Vermaas, Joshua
- RE: Loading large trajectories using multiple threads/direct calls? (Thu Dec 05 2019 - 12:12:45 CST)
- RE: Is it possible to use VMD to plot RDFs where the cell volume/parameter changes at each time step? (Wed Oct 23 2019 - 15:19:38 CDT)
- RE: Is it possible to use VMD to plot RDFs where the cell volume/parameter changes at each time step? (Wed Oct 23 2019 - 14:35:24 CDT)
- RE: Is it possible to use VMD to plot RDFs where the cell volume/parameter changes at each time step? (Wed Oct 23 2019 - 13:07:18 CDT)
- RE: measure rmsd with non-serial atom ordering between two selections (Tue May 07 2019 - 19:11:08 CDT)
- RE: measure rmsd with non-serial atom ordering between two selections (Tue May 07 2019 - 19:17:57 CDT)
- RE: RTX-accelerated VMD 1.9.4 test build for 64-bit Linux posted... (Mon Mar 11 2019 - 18:15:16 CDT)
- RE: MDFF through VMD Error FATAL ERROR: DIDN'T FIND vdW PARAMETER FOR ATOM TYPE OT (Fri Dec 21 2018 - 11:08:31 CST)
- RE: how to change material and color of an atom selection in TkConsole (Thu Nov 08 2018 - 18:55:32 CST)
- RE: namd-l: Re: PSFGEN 1.6.4 autogenerate PATCH keyword not available (Tue Apr 24 2018 - 12:08:20 CDT)
- RE: namd-l: Re: PSFGEN 1.6.4 autogenerate PATCH keyword not available (Tue Apr 24 2018 - 10:59:35 CDT)
- RE: Change in reaction coordinate value after doing solvation from that of the crystal structure (Thu Apr 12 2018 - 14:55:26 CDT)
- Re: Decompose Transformation Matrix to Rotations and Translations along XYZ axes (Fri Mar 23 2018 - 12:24:42 CDT)
- Re: How to calculate head group and acyl chain contact (separately) within 5 Anstrom of a particular protein residue? (Wed Jan 10 2018 - 12:31:02 CST)
- Re: Re: Re: How can I measure bond length with $B!H(Bname ** and resid **" in scripts? (Wed Dec 20 2017 - 12:21:47 CST)
- Re: Re: Re: How can I measure bond length with $B!H(Bname ** and resid **" in scripts? (Tue Dec 19 2017 - 12:09:13 CST)
- Re: I would like to get a trajectory file in PDB. Can I use like data frame in VMD? (Wed Dec 13 2017 - 12:24:47 CST)
- Re: Moving atoms so that origin is at fixed position with respect to the display (Thu Oct 26 2017 - 12:49:41 CDT)
- Re: vmdrc file not loaded when the filename is a command line argument (Sat Apr 01 2017 - 21:30:33 CDT)
- Re: "spiral cylinders" instead of bonds when rendering with Tachyon? (Thu Mar 23 2017 - 17:32:41 CDT)
- Re: VMD 1.9.3 GLSL rendering not available on Linux cluster Install (Tue Mar 21 2017 - 09:55:47 CDT)
- Re: Fwd: Termination when using QuickSurf, libGL no version info, and CUDA Error in start up (Wed Mar 01 2017 - 10:35:37 CST)
- Re: is there any plugin or software to combine PMF trajectory with VMD image? (Wed Feb 08 2017 - 14:28:31 CST)
- Re: .gro files written with python script not displayed until strange modification (Thu Feb 02 2017 - 16:40:25 CST)
- Re: How to determine periodicity and phase shift for ffTK dihedral parameter optimization? (Sat Dec 24 2016 - 08:40:07 CST)
- Re: How to determine periodicity and phase shift for ffTK dihedral parameter optimization? (Thu Dec 22 2016 - 08:49:59 CST)
- Re: Distribute evenly n-molecules at m-angstroem from protein surface (Sun Dec 04 2016 - 11:17:09 CST)
- Re: Rendering with Tachyon GPU enabled (TachyonLOptiXInternal) with options (Tue Nov 15 2016 - 13:12:23 CST)
- Re: Rendering with Tachyon GPU enabled (TachyonLOptiXInternal) with options (Sat Nov 12 2016 - 16:46:14 CST)
- Vermaas, Joshua V
- vermaasj
- Veronika Brazdova
- Verwandlung Die
- Victor Albert
- Victor Kwan
- vidhya sankar
- Vidyalakshmi CM
- Re: Viewing gromacs .xtc trajectory 'Error reading timestep, file does not match format' (Thu Jun 25 2015 - 10:39:21 CDT)
- Vieri Di Paola
- Vijay Vammi
- vijay_at_mbu.iisc.ernet.in
- Vijaya Brahma
- Vikas Dubey
- Vikas Varshney
- Re: coloring atoms based on max bond length; Need help with bond retrieval (Tue Oct 16 2012 - 13:37:55 CDT)
- Re: coloring atoms based on max bond length; Need help with bond retrieval (Tue Oct 16 2012 - 11:51:51 CDT)
- Re: coloring atoms based on max bond length; Need help with bond retrieval (Tue Oct 16 2012 - 10:11:24 CDT)
- viktor
- viktor drobot
- Villalain Boullon, Jose
- Vince Cho
- Vincent Leroux
- Vincent Ustach
- Vincent Wolowski
- Vineet Pande
- Vincius Aguiar
- Violina Sharma via LinkedIn
- virginia miguel
- Vishal Kopard
- Vishal Nemaysh
- Vishnu K
- Visvaldas Kairys
- VISWANADHA SRIDHARA
- Viswanadham Sridhara
- Viswanath Pasumarthi
- Vita Duka
- vitalini_at_zedat.fu-berlin.de
- Vitaly Vostrikov
- Vito Ashley
- Vivek Ranjan
- Vivek Sharma
- Viviane Corrêa
- Vlad Cojocaru
- 2016 ISQBP Meeting: early registration / abstract submission deadline approaching (Thu Mar 17 2016 - 03:48:59 CDT)
- Re: using the colvar module in VMD within a tcl loop through trajectory frames (Mon Apr 27 2015 - 11:24:46 CDT)
- using the colvar module in VMD within a tcl loop through trajectory frames (Mon Apr 27 2015 - 09:27:02 CDT)
- main menu rests to top molecule after each double click in a list of molecules (Tue Aug 21 2012 - 10:14:38 CDT)
- Re: main menu rests to top molecule after each double click in a list of molecules (Tue Aug 21 2012 - 10:17:12 CDT)
- Re: VMD fails to start/stalls/crashes on AMD workstation with Quadro FX 3800 (Fri Oct 07 2011 - 07:50:19 CDT)
- VMD fails to start/stalls/crashes on AMD workstation with Quadro FX 3800 (Wed Oct 05 2011 - 06:47:08 CDT)
- Fwd: Re: namd-l: How to evaluate the area per lipid and thickness of the lipid bilayer in a membrane-protein system? (Thu Aug 25 2011 - 02:14:15 CDT)
- converting coarse grained POPC membranes to atomistic representation (AMBER, GAFF) (Thu Aug 18 2011 - 07:06:32 CDT)
- Re: PhD position in Computational Structural Biology at MPI Muenster (Sun May 15 2011 - 13:47:01 CDT)
- Re: compilation with python 2.5 and file permissions from the CVS repository (Mon Apr 14 2008 - 05:43:00 CDT)
- Re: compilation with python 2.5 and file permissions from the CVS repository (Mon Apr 14 2008 - 05:16:25 CDT)
- Re: compilation with python 2.5 and file permissions from the CVS repository (Mon Apr 14 2008 - 03:26:35 CDT)
- preserving atom index or hexadecimal residue numbers after writepdb (Thu Jan 24 2008 - 04:44:40 CST)
- Re: script for mapping the electrostatic potential from APBS on surfaces (Wed Jan 26 2005 - 10:01:02 CST)
- script for mapping the electrostatic potential from APBS on surfaces (Wed Jan 26 2005 - 03:58:37 CST)
- vlad.chindea_at_pharmatech.ro
- vladanstefanovic_at_kg.ac.rs
- Vladimir Stegailov
- Vlastimil Zíma
- Vlastimil Zma
- vmd-l digest
- vmd-l_at_spider.med.jhmi.edu
- vmd_chcwaaa
- Vo Cam Quy
- Volodymyr Zloy
- vsharma
- vuissoz jean-marc
- vvenditti_at_biochem.wisc.edu
- Vy Phan
- Vyom Sharma
- Vctor
- Wagener, M. (Markus)
- Wallace Chan
- Wallace Dumars
- Walter Huang
- Walter Rocchia
- wang
- Wang Xianqiao
- Wang Yi
- Re: Making only a subset of atoms transparent (or otherwise non-emphasized) (Tue May 15 2012 - 13:44:17 CDT)
- Wang, Steven
- Wang, Yangzhou
- wangyong_at_dicp.ac.cn
- Wanlei Wei
- Wanzhi Qiu
- Warren DeLano
- Warren L. DeLano
- Wasim Abdul
- wayj86 wayj86
- Wayne Dawson
- Weatherby,Gerard
- wei
- Wei Chen
- Wei Fu (Linda)
- wei gao
- Wei Huang
- Wei Liu
- Wei-Lan Lin
- Weidong Xin
- weikai
- weilin Zhang
- Weiping Liu
- Weiqiang Wang
- weiz
- Weldon Sylvester
- Wen Li
- wenchangyu2006_at_gmail.com
- Wendy Gonzlez
- Wenhao Liu
- Re: charge exceed the range between Low bound and High bound in ffTK charge optimization (Fri Jun 07 2013 - 10:00:43 CDT)
- Re: charge exceed the range between Low bound and High bound in ffTK charge optimization (Fri Jun 07 2013 - 09:16:14 CDT)
- charge exceed the range between Low bound and High bound in ffTK charge optimization (Thu Jun 06 2013 - 21:58:35 CDT)
- Re: Is it necessary to set up more than 1 hydrogen bonding for one Acceptor in Water Int. in ffTK (Wed Apr 17 2013 - 13:11:22 CDT)
- Re: Is it necessary to set up more than 1 hydrogen bonding for one Acceptor in Water Int. in ffTK (Wed Apr 17 2013 - 13:17:42 CDT)
- Re: Is it necessary to set up more than 1 hydrogen bonding for one Acceptor in Water Int. in ffTK (Wed Apr 17 2013 - 12:46:20 CDT)
- Wesley Smith
- White, Mark
- Whiteside, Alexander
- Whitford, Paul
- Will Bricker
- Will Sheffler
- William A. Shelton
- William Glass
- William Howe
- Creating PDB files of binding pockets that lists ligands first within the file (Tue Feb 02 2021 - 18:14:55 CST)
- William Ray
- William Sheffler
- Williams Miranda
- Willie Bray
- Willie Maddox
- Willy Wriggers
- Wim R. Cardoen
- Win Liu
- winardi, erik
- Windle,Stephen
- wliu
- wmsmith
- Wojciech Rajchel
- Wolbach, Jeffrey P \(WOLBACH\)
- Wolf Dapp
- wolfinbm_at_uci.edu
- Saving mutli-molecule structures in VMD (e.g., for building membranes) (Sun Feb 04 2007 - 22:20:41 CST)
- Re: Trying to Build a Membrane w/conical pore out of PET (polyethylene terephthalate) (Sun Dec 24 2006 - 14:35:08 CST)
- Re: Trying to Build a Membrane w/conical pore out of PET (polyethylene terephthalate) (Sun Dec 24 2006 - 13:07:28 CST)
- Re: Trying to Build a Membrane w/conical pore out of PET (polyethylene terephthalate) (Fri Dec 22 2006 - 14:29:56 CST)
- Wong Li Zhe
- Woodson, Michael
- WT Ren
- WuChaofu
- wurl
- Wuwei Liang
- wuxiao
- xaneorat_at_mail.uni-paderborn.de
- Xavier Cartoixa Soler
- Xavier Periole
- Xiang Gao
- Xiang Yu
- Xiang, Tian-Xiang
- Xiangyun Qiu
- Xiao-Ping Zhang
- Xiaogang Wang
- Xiaohu Hu
- Xiaohui She
- xiaoqin huang
- Xiaoqing Wang
- xiaoyu qing
- Xifang Wang
- Xijun Wang
- Xinqiang Ding
- Xinyu(cindy) Li
- Xiongce Zhao
- Xu
- Xu Zhiping
- Xunlei Wu
- XY
- xzhao_at_uiuc.edu
- xzp02_at_mails.tsinghua.edu.cn
- Y U Sasidhar
- Y Xu
- Y. U. Sasidhar
- Ya.Shashel
- Yalini
- yalini.pathy_at_yale.edu
- Yamada, Masako (GE Global Research)
- YAMAZAKI Takeshi
- Yamei
- Yan Shen
- yan zhang
- Yang Yang
- Yang Zhenyu
- Yang, Shaorui
- YangMingjun
- Yangyang Shen
- Yann Claveau
- Yann Fichou
- Yanxiao Han
- Yarrow Madrona
- RE: how to convert dcd AND ALIGN molecules then to pdbs in command line (Thu Apr 11 2013 - 12:24:41 CDT)
- RE: how to convert dcd AND ALIGN molecules then to pdbs in command line (Thu Apr 11 2013 - 08:33:14 CDT)
- Re: how to convert dcd AND ALIGN molecules then to pdbs in command line (Thu Apr 11 2013 - 08:25:43 CDT)
- Yasaman Ghadarghadr
- Yaser Khan
- Yasser Almeida Hernndez
- Yasser Almeida-Hernandez
- Re: FFTK - issue after hessian loading during bonds/angles optimization (Tue Aug 11 2020 - 05:32:05 CDT)
- FFTK - issue after hessian loading during bonds/angles optimization (Mon Aug 10 2020 - 04:41:58 CDT)
- Re: Error Qbug=3F=29=20with=20Simulated=20anne?= aling in FFTK-Bond/Angle opt (Thu Aug 06 2020 - 10:52:46 CDT)
- Re: Error Qbug=3F=29=20with=20Simulated=20anne?= aling in FFTK-Bond/Angle opt (Thu Aug 06 2020 - 01:36:32 CDT)
- ybomble
- Yesica Pena
- Yew Yong Kin
- yi
- Yi Shang
- Yi Wang, PhD
- YI Zhang
- yifat b
- Yifat Brill
- Yifei Kong
- Yihua Zhou
- ying xiong
- Yinghong
- Yinglong Miao
- Re: error messages "*** glibc detected *** free(): invalid pointer" (Wed Feb 18 2009 - 17:32:26 CST)
- Re: error messages "*** glibc detected *** free(): invalid pointer" (Mon Feb 16 2009 - 12:44:16 CST)
- Re: error messages "*** glibc detected *** free(): invalid pointer" (Mon Feb 16 2009 - 12:10:11 CST)
- Re: error messages "*** glibc detected *** free(): invalid pointer" (Mon Feb 16 2009 - 11:51:38 CST)
- YingZhe
- Yingzhe Liu
- Yixin Chen
- Re: Re: looking for help to solve FATAL ERROR: Didn't find vdw parameter for atom type C11 (Tue Mar 12 2024 - 10:30:55 CDT)
- Yiyan Kuang
- Yjcoshc
- Re: VMD 1.9.4 crashes after running the "Merge Structures" plugin (with psfgen 2.0) (Mon Apr 04 2022 - 11:18:41 CDT)
- Re: VMD 1.9.4 crashes after running the "Merge Structures" plugin (with psfgen 2.0) (Mon Apr 04 2022 - 10:14:48 CDT)
- yjcoshc_at_gmail.com
- Re: VMD 1.9.3 crashes during loading GROMACS trr trajectory in linux. (Thu Jun 01 2017 - 09:58:42 CDT)
- Re: VMD 1.9.3 crashes during loading GROMACS trr trajectory in linux. (Thu Mar 02 2017 - 19:36:47 CST)
- Yoav Atsmon-Raz
- Yogesh Aher
- YOGESH NARKHEDE
- Yogesh Sharma
- seeking suggestion in simulation analysis for pore lining residues in channel protein (Sat Jul 11 2020 - 08:49:42 CDT)
- Yohann Morille
- Yojana Joshi
- YOLANDA SMALL
- yong zhou
- Yongcheng Zhou
- yongle
- Yongmei Pan
- Yongmei Wang
- yongpingzeng
- yoongho
- Younes Ansari
- your1word_at_yahoo.com
- youtux
- Youyong Li
- yp sun
- Yu Chen
- Yu Fang
- Yu Liu
- Yu Wang
- Yu Zhou
- Yu,Wenjin
- Yuan Feng
- Yuan Xue
- Yuan Zhang
- Yubo Fan
- Yuchen Yuan
- Yue Yang
- Yufang Wang
- yuhl
- Yujie Wu
- Yunfeng Hu
- Yungok Ihm
- Yunjie Zhao
- yunshi11 .
- Yuri Nedialkov
- Yusu Wang
- Yuvam Bhateja
- Yves Frapart
- yx38
- yzhou_at_chem.umn.edu
- yzliu
- Z. Erge Akbas
- Z.Y.Qiu
- Zachariah Sinkala
- Zachary E Tibbs
- Zachary SMITH
- Zack Scholl
- zaheer qasmi
- zaizhi lai
- Zakaria Bouchouireb
- Zampighi, Lorenzo
- RE: vmd 1.8.3a7 no longer works after installing NVIDIA dr iver x86_64 -1.0-6106 (Thu Jul 08 2004 - 17:10:24 CDT)
- Zara Sands
- Zeinab Emami
- getting extra number of input file at the charge optimization phase/ ffTK (Wed Dec 03 2014 - 07:04:38 CST)
- Re: Re: Charge Optimization error: error deleting "base-wat.pdb": permission denied (Sat Nov 08 2014 - 15:28:08 CST)
- Re: Charge Optimization error: error deleting "base-wat.pdb": permission denied (Sat Nov 08 2014 - 10:30:55 CST)
- Charge Optimization error: error deleting "base-wat.pdb": permission denied (Sat Nov 08 2014 - 07:40:24 CST)
- Re: namd-l: Re: ffTK problem: initial parameter file is void of atoms! (Mon Oct 20 2014 - 14:27:30 CDT)
- Re: namd-l: Re: ffTK problem: initial parameter file is void of atoms! (Mon Oct 20 2014 - 14:15:16 CDT)
- Re: namd-l: Re: ffTK problem: initial parameter file is void of atoms! (Mon Oct 20 2014 - 14:14:23 CDT)
- zeynab hoseyni
- Fwd: namd-l: Modifying the equilibrium distance for a specific region of carbon nanotube in the parameter file (Mon Dec 26 2016 - 06:45:28 CST)
- Why wrapped and unwrapped trajectories show different energies over the time? (Sat Apr 23 2016 - 09:32:06 CDT)
- Re: Problem wit solvating carbon nano-tube, psfgen) error reading atoms from psf file (Sun Feb 28 2016 - 13:22:47 CST)
- zeynab hosseini
- Re: Problem with Psfgen 2.0 to create Drude FF .psf file for amino acid (Fri Jul 30 2021 - 04:47:35 CDT)
- Problem with Psfgen 2.0 to create Drude FF .psf file for amino acid (Thu Jul 29 2021 - 11:57:11 CDT)
- Zhang, Dansong
- Zhang, Jiong (MU-Student)
- Zhang, Tao
- zhangh1_at_umbc.edu
- ZHAO Lina
- Zhaochuan Shen
- Zhe Wu
- Zhen Qin
- Zhencheng Ren
- Zheng Hu
- zhenlong li
- Zhenquan Hu
- Zhenwei Lu
- zhenxing wang
- Zhenyu Lu
- Zhenyu Yang
- zhilei chen
- Zhimin Xiong
- Zhiyong Zhang
- zhjjvmd
- zhngbn_at_gmail.com
- Zhu Liang
- zhurx
- Zhuyi Xue
- Ziemys, Arturas
- ziemys_at_ecr6.ohio-state.edu
- Zilong HE
- zizi moradi
- zoran
- Re: Problem with generating psf and pdb files of metalloprotein made up of two fragments (Fri Mar 27 2015 - 06:04:37 CDT)
- Problem with generating psf and pdb files of metalloprotein made up of two fragments (Thu Mar 26 2015 - 13:45:59 CDT)
- Re: Script to impose coordinates from separate file onto equivalent selection of atoms (Thu Mar 26 2015 - 10:59:07 CDT)
- Re: FFTK most probably doesn't work with molecules containing new atom types (Mon Dec 15 2014 - 17:13:16 CST)
- Re: FFTK most probably doesn't work with molecules containing new atom types (Mon Dec 15 2014 - 14:28:29 CST)
- Re: FFTK most probably doesn't work with molecules containing new atom types (Sun Dec 14 2014 - 10:20:00 CST)
- Re: FFTK most probably doesn't work with molecules containing new atom types (Sat Dec 13 2014 - 18:54:35 CST)
- Re: FFTK most probably doesn't work with molecules containing new atom types (Sat Dec 13 2014 - 17:22:16 CST)
- Re: FFTK most probably doesn't work with molecules containing new atom types (Sat Dec 13 2014 - 16:04:25 CST)
- zoran matovic
- zsinkala_at_mtsu.edu
- ZT Yew
- Zu Thur Yew
- zubin mehta
- Zumot, Elia Nabil
- Zuzanna Jedlinska
- Zyla Dawid
- Z
- º
- ̲
- ع
- Éric Germaneau
- Զ
- Ӵ
- ѩ Pang Xueqin
-
- VMD crashes during the execution of a computational intensive TCL script (Mon Aug 20 2007 - 16:25:33 CDT)
- ͢
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- 冯艺漩
- 刘宸宇
- 刘志伟
- 孙业平
- 本村肇
- Re: Re: Re: How can I measure bond length with “name ** and resid **" in scripts? (Tue Dec 19 2017 - 22:01:20 CST)
- Re: How can I measure bond length with Q=80=9Cname_**_and_resid_**=22_in_scripts=3F?= (Tue Dec 19 2017 - 03:03:19 CST)
- How can I measure bond length with “name ** and resid **" in scripts? (Tue Dec 19 2017 - 01:56:45 CST)
- 李偉弘
- 李安邦
- 楚霸天下
- 王妙郡
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