AMBER Archive (2001)

Subject: Re: pressure with polarizable potentials

From: jim caldwell (caldwell_at_heimdal.compchem.ucsf.edu)
Date: Mon Apr 02 2001 - 16:51:10 CDT


Yes it does.

On Mon, 2 Apr 2001, Pavel Jungwirth wrote:

> Dear amber users,
> I am doing simulations (NpT, cubic box) of liquid solutions using amber6 and
> polarizable potentials. I wonder if the pressure printed in the output
> reflects also the polarizability contribution to the virial. Does anybody
> know? Thank you in advance.
> pavel
>

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