Re: [AMBER] xleap as a molecular viewer

From: Jason Swails <jason.swails.gmail.com>
Date: Tue, 17 May 2011 16:01:55 +0200

You need to use the "edit" command to bring up a GUI window.

On Tue, May 17, 2011 at 3:12 PM, Guenegou, Guillaume [ORDFR] <
GGUENEGO.its.jnj.com> wrote:

> Dear all,
>
> I would like to use xleap as a molecular viewer (I know it is not the
> best idea on earth, but I have to!). I believe it is possible. I work
> with Amber11.
>
> My command is: $AMBHOME/exe/xleap -f leap.in
>
> leap.in =
>
> source leaprc.ff03.r1
>
> source leaprc.gaff
>
> complex = loadPdb file.pdb
>
>
>
> Is there anything I am doing wrong?
>
> Regards,
>
> G.GUENEGOU
>
>
>
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> http://lists.ambermd.org/mailman/listinfo/amber
>



-- 
Jason M. Swails
Quantum Theory Project,
University of Florida
Ph.D. Candidate
352-392-4032
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Received on Tue May 17 2011 - 07:30:02 PDT
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