[gmx-users] Handling modified residue

Jiang Zhu zhujiang2005 at gmail.com
Sat Nov 14 18:05:04 CET 2009


Dear all,

        I have been a GROMACS user for some time but this is my first time
to handle a modified residue with an additional chemical group linked to the
side chain. I do not have the permission to change/add the topology file in
the system directory where GROMACS package is located. I am wondering if
there is any other way to force pdbgmx to read residue topo file from
specified location or other tricks I can play. Thanks for your help!

Best regards,
Jiang
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://maillist.sys.kth.se/pipermail/gromacs.org_gmx-users/attachments/20091114/be8449ac/attachment.html>


More information about the gromacs.org_gmx-users mailing list