[gmx-users] NVT problem
akanxatiwari24 at gmail.com
Sat Sep 22 17:56:27 CEST 2018
i am trying to simulating a protein after run NVT md run i got a not what i
will do. is this not show any problem.
Back Off! I just backed up nvt.edr to ./#nvt.edr.1#
starting mdrun 'TUBULIN ALPHA CHAIN'
50000 steps, 100.0 ps.
step 49900, remaining wall clock time: 35 s
Writing final coordinates.
step 50000, remaining wall clock time: 0 s
NOTE: Detected invalid cycle counts, probably because threads moved between
CPU cores that do not have synchronized cycle counters. Will not print the
Core t (s) Wall t (s) (%)
Time: 70001.934 17500.483 400.0
Performance: 0.494 48.611
GROMACS reminds you: "Uh-oh .... Right Again" (Laurie Anderson)
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