[gmx-users] trjconv in Parallel run

Jochen Hub jhub at gwdg.de
Fri Oct 17 13:01:23 CEST 2008


sudheer babu wrote:
> Hi all,
> I have been running mdrun in Parallel for few hours due to full disk it
> crashed in between, later when I use trjconv command trjconv -f .trr -o xtc
> for convert .trr to .xtc its showing
> 
> "Program trjconv, VERSION 3.3.1
> Source code file: trnio.c, line: 66
> 
> File input/output error:
> Can not determine precision of trn file"

have you tried trjconv -ndec ?

Jochen

> 
> cant I make .trr to .xtc?
> what may be the problem how can I remedy this error.
> Any suggestions would be appreciated
> Thanks in advance
> 
> 
> 
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-- 
************************************************
Dr. Jochen Hub
Max Planck Institute for Biophysical Chemistry
Computational biomolecular dynamics group
Am Fassberg 11
D-37077 Goettingen, Germany
Email: jhub[at]gwdg.de
Tel.: +49 (0)551 201-2312
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