Re: AMBER: least square fit of snapshots in md trajectory to a reference frame

From: David A. Case <case.scripps.edu>
Date: Fri, 1 Jul 2005 08:51:21 -0700

On Fri, Jul 01, 2005, Ye Mei wrote:
>
> Can anyone tell me how to superimpose snapshots in md trajectory to a
> reference frame with least-square fit method? Is there any software that can
> help to do this?

See the "rms" command in ptraj.

....dac
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Received on Fri Jul 01 2005 - 17:53:01 PDT
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