Re: AMBER: new leap with old gibbs

From: David A. Case <>
Date: Tue, 6 Apr 2004 14:31:10 -0700

On Tue, Apr 06, 2004, Carsten Detering wrote:
> what is the proper usage in xleap/amber8 for the 'set default gibbs on'
> before the saveamberparmpert command, to use the old gibbs for TI?

set default gibbs on

works for me. Can you double check your typing? Also, note if you are going
to "edit" a unit, you will have to enter the perturbed status in the "unused"
column; it might be easier to use amber7 leap for gibbs.

....good luck...dac
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Received on Tue Apr 06 2004 - 22:53:00 PDT
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