Re: [AMBER] maximum coordination exceeded $ set pert true

From: Jason Swails <jason.swails.gmail.com>
Date: Thu, 7 Oct 2010 10:07:35 -0400

Did you try sleap?

On Thu, Oct 7, 2010 at 9:58 AM, William Flak <williamflak.yahoo.com> wrote:

> Dear AMBER
> I have a problem in constructing more than 6 bonds to a metal ion in the
> active site.
> I have tried set command without any progress:
> set complex.51.CA pert true
> it always give me the following error:
> Bond: maximum coordination exceeded on .R<CAX 51>.A<CA 1>
> -- setting atoms pert=true overrides default limits
>
> I see, set command solved this problem for the others, but why it doesn't
> work with me.
> Is there any bugfix related to this problem?
> Any kind of help would be appreciated
> Thanks in advance
> W. Flak
>
>
>
>
>
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>



-- 
Jason M. Swails
Quantum Theory Project,
University of Florida
Ph.D. Graduate Student
352-392-4032
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Received on Thu Oct 07 2010 - 07:30:03 PDT
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