I am interested in creating amber parameter and coordinate files for use in
OpenMM that fully describe the implicit solvent parameters of the CHARMM19
force-field. Is it possible to do this with chamber, or another function in
AMBERTOOLS? It seems that chamber accepts as input the CHARMM19 parameter
and topology files, but I cannot specify the implicit solvent explicitly
(defined in the CHARMM solvpar.inp file).
Thanks,
Anna
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Received on Tue Jul 31 2012 - 09:00:03 PDT
