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cluster:175 [2018/09/23 12:07] hmeij07 [P100 vs GTX & K20] |
cluster:175 [2018/09/23 12:22] hmeij07 [Gromacs] |
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localhost, | localhost, | ||
localhost, | localhost, | ||
- | gmx_mpi mdrun -gpu_id 0123 -ntmpi 0 \ | + | gmx_mpi mdrun -gpu_id 0123 -ntmpi |
-s topol.tpr -ntomp 4 -npme 1 -nsteps 20000 -pin on -nb gpu | -s topol.tpr -ntomp 4 -npme 1 -nsteps 20000 -pin on -nb gpu | ||