[gmx-users] Parallel run error
mn2 at hw.ac.uk
Fri Nov 26 20:04:56 CET 2004
Sorry for the delayed response. Yes, it runs on single node but it still
crashing and I get md.log file.It normally crashes between 7000 - 70000
> M.Naser wrote:
>> Hi Itamar !
>> Thanks for your response. It is still crashing.
>> Please give me some hint about likley problems.
> With the little info you gave till now, it's still guessing...!
> As David asked, can you run it on a single CPU?
> Did it even start (e.g. did you get the usual gromacs intro message
> printed on screen)?
> Did you get any output from mdrun at all (e.g., md0.log)?
> If so, how far along did you simulation (or minimization) get?
> No steps, a few steps, a few ps, a few ns?
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