[gmx-users] dmso/peptide simulation
prasun kumar
prasun30 at gmail.com
Tue Aug 19 10:08:36 CEST 2008
I am using the forcefield 43a2
option number 2 ie improved alkane dihedrals and i am using the same
dmso.gro and dmso.itp file that is given in the share/top file of
gromacs.but it is also right that the atom names are not matching in rtp
file.
I tried by replasing SDmso by SD in rtp file its not working again.........
with regards
--
PRASUN (ASHOKA)
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://maillist.sys.kth.se/pipermail/gromacs.org_gmx-users/attachments/20080819/863a8529/attachment.html>
More information about the gromacs.org_gmx-users
mailing list