[gmx-users] parallel

Gavin Melaugh gmelaugh01 at qub.ac.uk
Tue Mar 2 13:27:22 CET 2010


Hi gmx-users


I have been using gromacs now for a few months and have ran several
simulations in serial, which has been quit good. I now am trying to run
the simulations in parallel but seem to be having one or two little
problems. It seems that the computation does not run on more than two
CPUs. It runs using one and two CPUs. Does anyone have any idea why this
might be?

Cheers

Gavin



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