Re: AMBER: helix content during my simulation

From: julien <julien.pecher.u-picardie.fr>
Date: Mon, 06 Feb 2006 16:04:51 +0100

Thanks,

can send me yours python script? please

thanks for advance

> Usually, I convert snapshots to PDB files from the produced trajectory,
> and then perform dssp analysis on each PDB file.
> This procedure can be automated by a simple python script.
>
> Best,
> Mingfeng
>
> julien wrote:
> > Dear all,
> >
> > I want to "observe" the alpha helix content in my peptide during the
> > simulation.
> > Differents persons use the dssp program. How using the dssp program with
> amber ?
> > is-it with MMTSB or with ptraj or carnal?
> >
> > Sincerely yours
> >
> > best regards
> > julien
> >
> >
>
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-- 
Julien Pecher
Laboratoire de Biophysique, DMAG, INERIS-EA 3901
Faculte de Pharmacie, 1 rue des Louvels
80037 Amiens Cedex 1, France
Tel: +33 (0)3 2282-7786  Fax: +33 (0)3 2282-7469
     +33 (0)3 2282-7498
email: julien.pecher.u-picardie.fr
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Received on Tue Feb 07 2006 - 06:10:06 PST
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