[gmx-users] Carboxylate OPLS-AA parameters
rankinb
rankinb at purdue.edu
Sat Jan 25 21:18:26 CET 2014
I obtained the charges from the oplsaanb.itp file in the gromacs/share/top
directory. Do you know of a reference that provides the OPLS-AA parameters
for Asp or Glu?
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