[gmx-users] Small molecule - CHARMM
Steven Neumann
s.neumann08 at gmail.com
Thu Nov 3 11:26:39 CET 2011
Dear Gmx Users,
I have produced itp file using SwissParam - for CHARMM ff. As far as I know
using this topology is not a good idea and the charges of my atoms should
be parametrized. My question is how to do this? Will you suggest any
reading?
Regards,
Steven
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://maillist.sys.kth.se/pipermail/gromacs.org_gmx-users/attachments/20111103/5335b5b7/attachment.html>
More information about the gromacs.org_gmx-users
mailing list