VMD-L Mailing List

From: John Stone (johns_at_ks.uiuc.edu)
Date: Mon Feb 27 2006 - 11:13:22 CST

Hi,
  Nuno is correct. We haven't written code to write out XTC files in VMD,
but if someone with expertise wants to do this, I'd be happy to help them
with this.

  John Stone
  vmd_at_ks.uiuc.edu

On Mon, Feb 27, 2006 at 04:50:16PM -0000, Nuno R. L. Ferreira wrote:
> Hi
>
> I think that VMD is not able to that yet, but,
> it can save in .trr format:
>
> $sel writetrr your_file.trr
>
> regards,
> nuno
>
> ----- Original Message -----
> From: "L. Michel Espinoza-Fonseca" <mef_at_ddt.biochem.umn.edu>
> To: <vmd-l_at_ks.uiuc.edu>
> Sent: Monday, February 27, 2006 4:17 PM
> Subject: vmd-l: converting pdb to xtc
>
>
> > Dear all,
> >
> > I would like to know if there is a way to create a xtc trajectory
> > file from an ensamble of structures (pdb file) using vmd.
> >
> > Thank you in advance!
> >
> > Best wishes,
> >
> > Michel
> >
> >
> >
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-- 
NIH Resource for Macromolecular Modeling and Bioinformatics
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