From: Îº¿ (weikai_at_ustc.edu)
Date: Wed Nov 24 2004 - 22:13:49 CST
I have a question about the harmonic constraints.that is how to decrease the harmonic restraints gradually automaticly.such as at the beginning add 100 kcal/mol constraints in equI ,and 10ps later decrease to 50 kcal/mol.....
-- USTC Alumni Email System
This archive was generated by hypermail 2.1.6 : Wed Feb 29 2012 - 15:38:01 CST