Re: AMBER: thermodynamic integration of ring opening

From: Bill Ross <>
Date: Tue, 18 May 2004 12:08:13 -0700 (PDT)

> The method would be another example
> of the thermodynamic idea of "it doesn't matter what the path
> between them is, only the properties of the two end states" then,
> right?

Yes. The critical thing is whether the sampling along the path
is adequate.

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Received on Tue May 18 2004 - 21:53:00 PDT
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