[gmx-users] RB Dihedrals with ffamber96 in Gromacs 4.5.3?
rnowling at nd.edu
Tue Jan 11 16:50:46 CET 2011
This is my first time posting to the list, so please excuse any
ignorance on my part. I'm preparing a few test systems using Gromacs
4.5.3 with the ffamber96 forcefield. When I use gmxdump on the
resulting tprs, I see Proper Dihedrals but not RB Dihedrals. Does
ffamber96 use RB Dihedrals and is it an expected result to not contain
RB Dihedrals? For reference, I'm preparing DHFR and a ww mutant.
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