[gmx-users] ANTECHAMBER & GAFF
Dechang Li
li.dc06 at gmail.com
Sat Sep 29 16:22:59 CEST 2007
Dear gmx-users,
I want to use ANTECHAMBER & GAFF to generate the topology of a small molecular(HIV-1 Protease inhibitor, Nelfinavir) for gromacs.
But It seems to be not so simple. Is there anyone who did the similar thing before? Is there any tutorials?
With best regards,
2007-9-29
=========================================
Dechang Li, PhD Candidate
Department of Engineering Mechanics
Tsinghua University
Beijing 100084
PR China
Tel: +86-10-62773779(O)
Email: lidc02 at mails.tsinghua.edu.cn
=========================================
More information about the gromacs.org_gmx-users
mailing list