2669 (Run 12, Clone 50, Gen 159) Water molecule can not be s
Posted: Thu Jul 02, 2009 8:05 pm
t = 79500.014 ps: Water molecule starting at atom 80164 can not be settled.
Check for bad contacts and/or reduce the timestep.
This displays on the screen but is not written to a log file.
Brand new WU, last one (also 2669) finished just fine. Gromacs SMP Core. Happened once before but I just wiped out FAH and started over. Figured I report it this time.
Check for bad contacts and/or reduce the timestep.
This displays on the screen but is not written to a log file.
Brand new WU, last one (also 2669) finished just fine. Gromacs SMP Core. Happened once before but I just wiped out FAH and started over. Figured I report it this time.