Re: AMBER: helix content during my simulation

From: Mingfeng Yang <mfyang.gmail.com>
Date: Mon, 06 Feb 2006 09:03:32 -0500

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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Received on Tue Feb 07 2006 - 06:10:06 PST
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