From: Wenyu Zhong (wenyuzhong_at_gmail.com)
Date: Wed Apr 26 2006 - 09:34:31 CDT
I want to calculate Free energy with ABF along a rather long reaction path.
The only strategy is spliting the path into several parts?
I think It is more convenient to complete them in a single simulation.
This archive was generated by hypermail 2.1.6 : Wed Feb 29 2012 - 15:41:58 CST