Lee Soin wrote:
Hello!
How to specify the -multi option when doing REMD with mdrun? It seems
that this option has changed from bool to int type in version 4.0.
mpirun -np 24 mdrun -multi 4
will start 4 jobs at 6 processors each.
--
Sun Li
Department of Physics
Nanjing University, China
--
Hello!
How to specify the -multi option when doing REMD with mdrun? It seems that
this option has changed from bool to int type in version 4.0.
--
Sun Li
Department of Physics
Nanjing University, China
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