Re: [AMBER] attach pull release method exploration for free energy calculations

From: Carlos Simmerling <carlos.simmerling.gmail.com>
Date: Thu, 9 Jul 2020 16:24:12 -0400

You may want to contact the authors directly, I am not sure how often they
follow this list.

On Thu, Jul 9, 2020, 3:40 PM Debarati DasGupta <
debarati_dasgupta.hotmail.com> wrote:

> Hi
> Is there anyone in the mailing list who has applied the APR method to
> calculate binding affinities for protein ligand systems.
> I had some doubts and it will be good if someone can chime in. My doubts
> are related to
> https://ambermd.org/tutorials/advanced/tutorial29/index.html
> Thanks everyone
> Regards
>
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Received on Thu Jul 09 2020 - 13:30:04 PDT
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