[gmx-users] frozen group, pull code and COM motion removal
=?GB2312?B?ubPJ7tbC1LY=?=
goushenzhiyuan at gmail.com
Sun Sep 9 17:19:58 CEST 2007
Hi all,
Recently, I performed a simulation which have three groups: frozen group
(there's no connections with the other groups), free group (peptide), mobile
group (using AFM pulling of the pull code) . How should I set the comm._mode
and comm _grps in the mdp file?
Thanks,
Xiu Peng.
-------------- next part --------------
An HTML attachment was scrubbed...
URL: http://www.gromacs.org/pipermail/gmx-users/attachments/20070909/7a578918/attachment.html
More information about the gmx-users
mailing list