Re: [AMBER] Entropy Decomposition

From: Daniel Aiello <Daniel.Aiello.umassmed.edu>
Date: Fri, 24 Jun 2011 13:43:33 -0400

Thanks.
On Jun 24, 2011, at 11:57 AM, David A. Case wrote:

> On Fri, Jun 24, 2011, Daniel Aiello wrote:
>
>> Does Amber10 have a built in method for decomposing entropic components
>> on a per residue or pair-wise residue basis? Thanks,
>
> No. For biomolecules, the main contributions to entropy come from
> low-frequency, collective motions that are not associated with any particular
> residue.
>
> ....dac
>
>
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Received on Fri Jun 24 2011 - 11:00:03 PDT
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