From: Hasan haska (hasanhaska_at_yahoo.com)
Date: Thu Sep 22 2011 - 08:37:27 CDT
Dear Namd users,
I learned that getting the force for
each atom as a pdb file is a new feature of namd 2.8 version. I installed namd 2.8
version to get net forces on each atom but I couldn’t understand the
explanation “Net forces on each atom can be written to PDB or binary output
files using the Tcl output command as "output withforces basename" ” .
What should I do to get a force pdb file ? What is the meaning of “basename” ? Could you please help me to
learn this operation ?
Thanks for your help.
This archive was generated by hypermail 2.1.6 : Wed Feb 29 2012 - 15:57:46 CST