Re: [AMBER] CpHMD usage

From: Cruzeiro,Vinicius Wilian D <vwcruzeiro.ufl.edu>
Date: Fri, 7 Jun 2019 17:10:27 +0000

Hello Cesar,

This discussion seems to be on the same lines of your question: http://archive.ambermd.org/201904/0075.html

All the best,


Vinícius Wilian D. Cruzeiro

PhD Candidate
Department of Chemistry, Physical Chemistry Division
University of Florida, United States

Voice: +1(352)846-1633

________________________________
From: cpimenta <cpimenta.itqb.unl.pt>
Sent: Friday, June 7, 2019 6:08 AM
To: amber.ambermd.org
Subject: [AMBER] CpHMD usage

Hi,

Does Amber CpHMD work with other forcefields such as charm36m?
Does Amber implementation of CpHMD run exclusively (or almost) in GPU?

In my current project I'm working with a system built using charmm36m
and one of the molecules was parameterized for this FF. Is it possible
to "port" the topology I have to use with Amber?

Thank you

César

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Received on Fri Jun 07 2019 - 10:30:02 PDT
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