Re: [AMBER] Restraining non-bonded atoms

From: Carlos Simmerling <carlos.simmerling.gmail.com>
Date: Fri, 15 Apr 2011 09:05:29 -0400

this is straightforward. use the NMR restraints with nmropt=1. there
are examples in the manual and online. search the archives for
"disang" and you'll see plenty of examples of restraints.

On Fri, Apr 15, 2011 at 9:01 AM, nicholus bhattacharjee
<nicholusbhattacharjee.gmail.com> wrote:
> Dear community,
>                        I want to restrain distance of two non bonded atoms
> in my simulation. Can anyone please suggest me how to do that. Thank you in
> advance.
>
> --
> Nicholus Bhattacharjee
> PhD Scholar
> Department of Chemistry
> University of Delhi
> Delhi-110007 (INDIA)
> Phone: 9873098743(M)
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> AMBER mailing list
> AMBER.ambermd.org
> http://lists.ambermd.org/mailman/listinfo/amber
>

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Received on Fri Apr 15 2011 - 06:30:08 PDT
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