[gmx-users] trjconv warning
m-hatake at jaist.ac.jp
m-hatake at jaist.ac.jp
Tue Jun 21 23:07:14 CEST 2005
Thanks for reply, Pedro.
I tried
> trjconv -f traj.trr -s traj.tpr -o mid.pdb -dump 30000
but the result is same.
----------
Last frame 402 time 16080.001
WARNING: Incomplete frame: nr 403 time 16120
WARNING no output, trajectory ended at 16120
----------
my simulation is running and trajectory file(traj.trr)
size is still increasing, but 'traj.trr' data cannot
be recognized over 16000 [ps] for some reason.
I don't know why.
Other commands, g_density, g_rotacf etc., also stop
at the time 16000 [ps].
I try to check topol.top and grompp.mdp again.
Thanks.
masa
--
Masaomi Hatakeyama
Dept. of Chemical Engineering
University of California, Davis (UCDavis)
email: mhata at ucdavis.edu
From: paloureiro at biof.ufrj.br
Subject: Re: [gmx-users] trjconv warning
Date: Tue, 21 Jun 2005 18:22:06 +0000
> > Dear All,
> >
> > I tried to do 'trjconv' as following since I want to see a snapshot of my
> > simulation.
> >
> > > trjconv -f traj.trr -o mid.pdb -b 30000 -e 30000
> >
> Try to use
>
> trjconv -f traj.trr -s traj.tpr -o mid.pdb -dump 30000
>
> Regards.
>
> Pedro.
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