[gmx-users] Topology and box for DMSO and MeOH

[Christoph Freudenberger]

Hi there,

I have uploaded two more packages providing the topology,
an equilibrated box and a run input file
for

DMSO ( A. Laaksonen et.al., J. Phys. Chem. A, 105,2001,1702 )

and

MeOH ( W.F. van Gunsteren et.al., JCP 112, 2000, 10450 )

to the gromacs topologies:
http://www.gromacs.org/topologies/molecules.php

have fun with it.
-- 
Christoph Freudenberger
Abt. Organische Chemie I AK Siehl - Uni Ulm -Tel: ++49-731-502-2785