Anirban Ghosh wrote:
Thanx Tsjerk for the reply.
I checked the .trr files with gmxcheck and one of the .trr files is
giving the error:
---------------------------------------------------------------------------------------------------------------------------
Checking file PRO_DAH_10_NS.part0004.trr
trn version: GMX_trn_file (single precision)
Reading frame 0 time 10000.000
# Atoms 135496
Reading frame 1400 time 12800.001
-------------------------------------------------------
Program gmxcheck, VERSION 4.0.5
Source code file: trnio.c, line: 66
File input/output error:
Can not determine precision of trn file
----------------------------------------------------------------------------------------------------------------------------
Is there any way to recover this .trr file? Or do I need to re-run the
simulation again?
Probably. Did the simulation end correctly? Did you run out of disk space?
Mark
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