[gmx-users] Re: trjcat -demux problem

[Jianhui Tian]

I solved the problem.

The command that works is:
trjcat -f md00.xtc md01.xtc ... md0N.xtc -o out00.xtc out01.xtc ...
out0N.xtc -s replica_index.xvg

Jianhui

Date: Tue, 03 Nov 2009 10:24:12 -0500
From: "Justin A. Lemkul" <jalemkul at vt.edu>
Subject: [gmx-users] Re: trjcat -demux problem
To: Jianhui Tian <tianj at rpi.edu>, "Gromacs Users' List"
       <gmx-users at gromacs.org>
Message-ID: <4AF04B1C.3000900 at vt.edu>
Content-Type: text/plain; charset=ISO-8859-1; format=flowed


Please keep all correspondence on the gmx-users list.  I do not advertise
myself
as a private help service, and furthermore, you always stand a better chance
at
getting a response by posting to the list.

Is this the post you're referring to?

http://lists.gromacs.org/pipermail/gmx-users/2008-December/038719.html

It's always best to refer directly to the thread you read.

What version of Gromacs are you using?  I seem to recall that the quoted
error
came up in 3.3.3, but not in the 4.0.x series.  I never actually solved the
above problem; my issue was with version 4.0.2, and it ended up being my own
fault for using an improper command :)

-Justin

Jianhui Tian wrote:
> Hi Justin,
>
> I found your post on gromacs mailing list when I searched for the
> "trjcat -demux" problem.
>
> I had the same problem as you had before:
>
> Fatal error:
> Demuxing the same replica 4 twice at time 30.000002
>
> Unfortunately, I didn't find any successful hit to solve it on the
> mailing list.
> Could you please share with me how to solve the problem if you have
> solved it?
> Thank you very much.
>
> Jianhui
>
>
>
>
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