amber-developers: force field information in topology files

From: Junmei Wang <>
Date: Tue, 24 Jun 2008 18:54:20 -0700 (PDT)

Hi, everyone,
Recently, when I deal with some old topology files I have a big trouble to figure out which force fields I ever used. I would like to suggest to put force field information at the beginning of the topology files. The file names of parm???.dat and frcmods should be good enough ...



Received on Wed Jun 25 2008 - 06:07:56 PDT
Custom Search