[gmx-users] Carboxylate OPLS-AA parameters

rankinb rankinb at purdue.edu
Sun Jan 26 20:55:58 CET 2014

Alternatively, I could use the parameters for a carboxylate head group, the
neighboring CH2 group and then alcohol parameters for the rest of the CH2
groups and terminal CH3.  This would probably make more sense.  Does anyone
else agree?

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