Re: SMD under NPT ensemble

From: Wang Yi (
Date: Mon Mar 19 2012 - 10:20:07 CDT

There are instructions on how to do SMD in NAMD, using either the configuration file or the latest ColVar technique.

You can find them in the NAMD manual online.

Yi (Yves) Wang
Duke University

On 2012-3-19, at 上午11:12, raghav singh wrote:

> Hello All,
> I wanted to know about SMD simulation using NPT ensemble...
> NAMD has this freedom or not... any suggested article would be off great help.
> Thank You all
> regrads
> Raghav

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