[gmx-users] Running gromacs in parallel on multicore machine

Sikandar Mashayak symashayak at gmail.com
Tue Jun 1 23:14:43 CEST 2010


I am wondering whether its possible to run gromacs in parallel on single
processor machine with multiple cores?

I have 8 core processor, when I run mdrun in serial I see only one of those
is used at 100%. I am thinking, if possible, to use all cores approximately
equally by running mdrun in parallel and hoping to get results faster.

Any suggestions?

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