Re: [AMBER] Restraint

From: case <>
Date: Thu, 24 Jun 2010 10:34:30 -0400

On Thu, Jun 24, 2010, John S wrote:
> I would like to know is there any way of using restraint only for selected
> atoms .
> Since in my system I need to restraint a part of each residue .
> And how should I separate them .I used it as below which does not work :
> restraintmask ='1.N;2.C'

See Appendix C of the Amber Users' Manual, which describes the ambmask
program that helps in getting the mask to do what you want; it has
examples that look very close to what you seem to be trying to do.


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Received on Thu Jun 24 2010 - 08:00:07 PDT
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