Re: [AMBER] Entropy can be neglecected under which condition

From: sunita gupta <sunita.bio.gmail.com>
Date: Tue, 3 Nov 2015 14:52:22 +0530

Yes, when we are doing the relative studies, entropy can be neglected

On Tue, Nov 3, 2015 at 2:35 PM, Marc Zhang <marczhang_md.zoho.com> wrote:

> Dear amber users group
>
>
>
> I would like to know the entropic term can be neglected under which
> conditions during MMPBSA calculation?
>
>
>
> Can I neglect the term when calculating the binding free energies of
> different ligands to the same protein?
>
>
>
> Thanks a lot for your help!
>
>
>
> Cheers
>
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SUNITA GUPTA
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Received on Tue Nov 03 2015 - 02:00:03 PST
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