[gmx-users] restarting simulation after segmentation fault
za.pour at yahoo.com
Tue May 8 17:40:53 CEST 2012
Dear gmx users
I am simulating a system involving carbon nanotube.
I successfully completed the EM,NVT and NPT equilibration phase and then
started to run production simulation(NVT ensemble) for 10 ns.However,
after passing more than 500000 steps(1 ns),I gave the segmentation error.I investigated log file but it did not contain any errors so I used tpbconv and mdrun to restart the simulation.I would be pleased if you could tell me whether restarting the simulation after segmentation fault is correct or not?
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