[AMBER] which fitting methods should I use for OPLS FF?

From: Albert <mailmd2011.gmail.com>
Date: Sat, 21 Jan 2012 07:23:03 +0100

Hi:
   I am going to use OPLS_AA for my MD system which contains a ligand. I
am wondering which Fitting methods should I use for my ligand? Is ESP-A1
or ESP-C1 suitable for it?

thx

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Received on Fri Jan 20 2012 - 22:30:03 PST