From: bo baker (bo.bybaker_at_gmail.com)
Date: Tue Jan 10 2006 - 16:00:19 CST
What is the difference between NPT (constant number, constant pressure
and constant temperature) simulation and equilibration at constant
temperature without any restrains on the atom? I look at the .conf
files, and can't tell the difference. Which part of .conf tells NAMD
to do the simulation rather equilibration?
This archive was generated by hypermail 2.1.6 : Wed Feb 29 2012 - 15:41:31 CST