Re: [AMBER] md simulation on parallel PMEMD

From: David A. Case <case.biomaps.rutgers.edu>
Date: Mon, 2 Feb 2009 08:54:58 -0500

On Mon, Feb 02, 2009, oguz gurbulak wrote:

> this parallel version only works for ntc < 3
>
> Isn't it possible to use ntc=3, ntf=3, on parallel PMEMD ?

It would seem that the error message from the program has answered your
question. Although error messages from Amber are often obscure, in this
case the message seems pretty straightforward. The same limitation exists
for sander.

...dac


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Received on Wed Feb 04 2009 - 01:18:15 PST
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