[gmx-users] Corrupt trajectories
Amil Anderson
aanderson at wittenberg.edu
Fri May 27 01:47:13 CEST 2005
I have recently finished a very long MD simulation that created a 87
Gigabyte .trr trajectory file and a 23 Gigabyte .xtc file. When
using trjconv to sample these trajectories the programs fails on the
148,760th frame with a fatal error: "Can not determine precision of
trn file". The fatal error occurs at the same frame when I am
reading either the .trr or the .xtc file. Is there a way to get to
the remaining 85% of the file?
I have tried skipping the first 149,000 frames using the -b option
but still get caught at frame 148,760
Thanks for any assistance that can be provided.
Amil Anderson
Associate Professor of Chemistry
Wittenberg University
Springfield, OH 45501
More information about the gromacs.org_gmx-users
mailing list