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Commit c1e6c60b authored by Jan Meinke's avatar Jan Meinke
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Fix style problems.

parent 5dc166f2
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Golden_Repo/g/GROMACS/GROMACS-2020.4-gpsmkl-2020.eb
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− 4
View file @ c1e6c60b
......@@ -50,10 +50,9 @@ dependencies = [
('CUDA', '11.0', '', True),
]
#configopts = "-DCUDA_HOST_COMPILER=$EBROOTGCCCORE/bin/gcc -DCUDA_PROPAGATE_HOST_FLAGS=OFF -DCUDA_NVCC_FLAGS='-std=c++14' "
#configopts += '-DMPIEXEC_MAX_NUMPROCS="24"'
configopts = '-DCMAKE_PREFIX_PATH=$EBROOTHWLOC -DMPIEXEC_MAX_NUMPROCS="24" '
configopts += '-DMKL_LIBRARIES="${MKLROOT}/lib/intel64/libmkl_intel_ilp64.so;${MKLROOT}/lib/intel64/libmkl_sequential.so;${MKLROOT}/lib/intel64/libmkl_core.so" '
configopts += '-DMKL_LIBRARIES="${MKLROOT}/lib/intel64/libmkl_intel_ilp64.so;'
configopts += '${MKLROOT}/lib/intel64/libmkl_sequential.so;${MKLROOT}/lib/intel64/libmkl_core.so" '
configopts += '-DGMX_CUDA_TARGET_SM="60;70;80" '
mpiexec = 'srun'
......
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