Re: AMBER: about FEP

From: David A. Case <case.scripps.edu>
Date: Tue, 2 Nov 2004 08:19:27 -0800

On Tue, Nov 02, 2004, Annette Ho"glund wrote:

> Could someone help and perhaps post an input for sander TI (and perhaps
> also the min and equil input before that) applicable to a protein?

There are several examples in the $AMBERHOME/test/pheTI subdirectory. See
the "Notes" file there for an explanation.

....dac

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Received on Tue Nov 02 2004 - 16:53:01 PST
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