[gmx-users] OPLS and free energy runs

Rainer Boeckmann rboeckm at gwdg.de
Wed May 14 16:44:01 CEST 2003

Hi all,

I'm looking for a gromacs-version (3.1.5 beta?) which allows to change the
dihedrals (free energy run) using the opls-forcefield (cvs doesnt't work). Can
anybody provide a respective source code?


Dr. Rainer Böckmann
Theoretical Molecular Biophysics Group
Max-Planck-Institute for Biophysical Chemistry
Am Faßberg 11
D-37077 Göttingen

tel:    +49(551)201-1141
mobile: +49(172)9531168
fax:    +49(551)201-1089

email: rboeckm at gwdg.de


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