[gmx-users] Gmxcheck error - "Fatal error: Can not determine precision of trn file, quit!"

David spoel at xray.bmc.uu.se
Wed Jul 27 21:13:20 CEST 2005


On Wed, 2005-07-27 at 13:58 -0500, Jeffrey Copps wrote:
>      Hello all,
> 
>      I was running gmxcheck on a recently completed simulation and got
> the error referenced in the subject line at 3400 ps.  Is there any way
> to work around this?
I take it your simulation is longer than that? Then there is an error in
the file.

For XTC files the new CVS code will allow you to hop over the error and
continue analysing at say 3401 ps. However it hasn't been implemented
for trr files yet.

> 
>      Thanks,
> 
>      Jeffrey Copps
> 
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-- 
David.
________________________________________________________________________
David van der Spoel, PhD, Assoc. Prof., Molecular Biophysics group,
Dept. of Cell and Molecular Biology, Uppsala University.
Husargatan 3, Box 596,          75124 Uppsala, Sweden
phone:  46 18 471 4205          fax: 46 18 511 755
spoel at xray.bmc.uu.se    spoel at gromacs.org   http://xray.bmc.uu.se/~spoel
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