[gmx-users] nonbonded LJ-parameters
Berk Hess
gmx3 at hotmail.com
Mon Mar 7 19:09:48 CET 2005
>I have a remark/question concerning the use of nonbonded LJ-parameters in
>GROMACS.
I have recently fixed the nonbond_params and pairs section to read
sigma/epsilon
for combination rules 2 and 3.
This fix is in CVS and will be in the next release.
Berk.
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