[gmx-users] xtc with perl

[gromacs query]

Thanks Mark. I was just avoiding  recoding my long perl analysis script to
mdanalysis/pycpptraj format. Now I think there is no escape :)

J

On Fri, Jun 30, 2017 at 12:52 PM, Mark Abraham <mark.j.abraham at gmail.com>
wrote:

> Hi,
>
> I suggest using python projects like mdanalysis or cpptraj, which read xtc
> files, or using the GROMACS C++ analysis tools template, rather than
> wasting time writing your own code to read them. If you really must, then
> you should wrap this library
> http://www.gromacs.org/Developer_Zone/Programming_Guide/XTC_Library.
>
> Mark
>
> On Fri, Jun 30, 2017 at 1:30 PM gromacs query <gromacsquery at gmail.com>
> wrote:
>
> > Hi all,
> >
> > I would like my perl script to analyse xtc trajectory file directly
> instead
> > of analysing human readable extracted frame files (pdb/gro etc.) to save
> > disk space. I could not find much on mailing list but there was a brief
> > reference about using Swig which I could not understand how to start with
> > it.
> >
> > Any help or suggestion is much appreciated to start with.
> >
> > Thanks
> > Jiom
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