Re: AMBER: NTT for production run

From: Vlad Cojocaru <Vlad.Cojocaru.eml-r.villa-bosch.de>
Date: Tue, 14 Mar 2006 09:44:35 +0100

Hi,

ntt=1 with a higher tautp (weak coupling) should be preferred ...
(please also check the amber tutorials ... there is a detailed
explanation there)

vlad



snoze pa wrote:

>Dear Amber users,
> What value of NTT is suitable for production MD run, ntt=1 or ntt=3.
>thanks in advance
>snoze
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-- 
Dr. Vlad Cojocaru
EML Research gGmbH
Molecular and Cellular Modeling Group
Schloss-Wolfsbrunnenweg 33
69118 Heidelberg, Germany
Phone: +49-6221-533266
Fax: +49-6221-533298
e-mail: Vlad.Cojocaru.eml-r.villa-bosch.de
http://projects.villa-bosch.de/mcm/people/cojocaru/
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Received on Sun Mar 19 2006 - 06:10:10 PST
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