How to prepare FEP input files for double mutant

From: Aman (sangha11_at_gmail.com)
Date: Wed Aug 28 2013 - 15:05:19 CDT

• Next message: Steven Mike: "eigenvector colvar"
• Previous message: Norman Geist: "WG: questions regarding the source code in NAMD"
• Messages sorted by: [ date ] [ thread ] [ subject ] [ author ] [ attachment ]

Dear All,

Using Mutate Residue plugin in VMD I can prepare input files (.fep and
.psf) for FEP simulation only for one residue. Can someone explain to me
how to get psf and fep input files for a double mutant?

-- 
Aman

• Next message: Steven Mike: "eigenvector colvar"
• Previous message: Norman Geist: "WG: questions regarding the source code in NAMD"
• Messages sorted by: [ date ] [ thread ] [ subject ] [ author ] [ attachment ]

This archive was generated by hypermail 2.1.6 : Tue Dec 31 2013 - 23:23:37 CST