Re: [AMBER] Is GAFF polarizable forcefield ??

From: David A Case <david.case.rutgers.edu>
Date: Fri, 17 Nov 2017 07:54:15 -0500

On Fri, Nov 17, 2017, Saikat Pal wrote:

> Is GAFF polarizable forcefield ?? In gaff.dat file for all amber atoms,
> there is some polarizability. I am little bit confused.

No: gaff is not a polarizable force field. The "polarizability" entry arises
from an historical file development (not important to go into here.)

....dac


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Received on Fri Nov 17 2017 - 05:00:02 PST
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