[gmx-users] valid command line argument do i use by mdrun_mpi_d for 8 cores.

Mahboobeh Eslami mahboobeh.eslami at yahoo.com
Fri Nov 29 21:11:29 CET 2013


i want to install gromacs4.6.3 on 8 core.
i use following command:

CMAKE_PREFIX_PATH=/usr/local/openmpi/:/home/elahe/ComTools/fftw/ cmake .. -DGMX_MPI=ON -DGMX_THREAD_MPI=ON -DBUILD_SHARED_LIBS=OFF -DGMX_PREFER_STATIC_LIBS=ON -DGMX_DOUBLE=ON -DCMAKE_INSTALL_PREFIX=/home/elahe/ComTools/gromacs
is it correct?
What command do I use to use 8 cores? which valid command line argument do i use by mdrun_mpi_d for 8 cores.
thanks a lot


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