Date: Wed Jun 20 2007 - 10:27:53 CDT
1) From the webpage below, I am gathering that PSF files in XPLOR or CHARMM formats will run in
NAMD as a CHARMM MD simulation. Is this the case?
2) I installed NAMD 2.6 from source code and CHARMM was installed with it. The webpage above
states that CHARMM19, CHARMM22, and CHARMM27 file formats are supported by NAMD. How many versions
of the CHARMM force field are included by default in NAMD 2.6? I.e., how do I know which version of
CHARMM I am using for my MD simulation?
Thank you in advance.
-- Audrey L. Salazar Amaral Research Group Dept. of Chemical and Biological Engineering Phone: 847.491.2188 Northwestern University Evanston, IL USA
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