easyconfigs-it4i/o/OpenMPI/OpenMPI-4.1.2-NVHPC-22.2-CUDA-11.6.0-v2.eb
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	modified:   g/GROMACS/GROMACS-2020.4-fosscuda-2020b-PLUMED-2.7.0-patch.eb
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	modified:   p/protobuf/protobuf-2.5.0.eb
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	new file:   u/UCX/UCX-1.11.2-GCC-10.2.0-CUDA-11.6.0.eb
	new file:   u/UCX/UCX-1.11.2-NVHPC-22.2-CUDA-11.6.0.eb
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	deleted:    z/zlib/zlib-1.2.11.eb
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# IT4Innovations
# LK 2022
name = 'OpenMPI'
version = '4.1.2'
versionsuffix = '-CUDA-11.6.0-v2'
homepage = 'https://www.open-mpi.org/'
description = """The Open MPI Project is an open source MPI-3 implementation."""
toolchain = {'name': 'NVHPC', 'version': '22.2'}
source_urls = ['https://www.open-mpi.org/software/ompi/v%(version_major_minor)s/downloads']
sources = [SOURCELOWER_TAR_GZ]
dependencies = [
('UCX', '1.11.2', '-NVHPC-22.2-CUDA-11.6.0', True),
('CUDAcore', '11.6.0', '', True),
]
preconfigopts = 'export CC="pgcc -noswitcherror" && export CXX="pgc++ -noswitcherror" && export FC="pgfortran -noswitcherror" && '
configopts = '--enable-shared --enable-mpi-thread-multiple --with-verbs '
configopts += '--with-hwloc=$EBROOTHWLOC ' # hwloc support
configopts += '--enable-mpirun-prefix-by-default '
configopts += '--with-tm=/opt/pbs ' # Enable PBS
configopts += '--enable-mpi-cxx ' # Enable building the C++ MPI bindings
configopts += '--with-ucx=$EBROOTUCX '
configopts += '--with-cuda=$EBROOTCUDACORE '
moduleclass = 'mpi'
#setenv("OMPI_MCA_btl_openib_if_include", "mlx5_0")
#setenv("export OMPI_MCA_btl_openib_allow_ib", "1")
#setenv("OMPI_MCA_pml", "^ucx")
#setenv("OMPI_MCA_orte_base_help_aggregate", "0")
import os
if os.environ.get("CLUSTERNAME") in ["BARBORA"]:
modextravars = {'OMPI_MCA_btl_openib_if_include': 'mlx5_0',
'OMPI_MCA_btl_openib_allow_ib': '1',
'OMPI_MCA_orte_base_help_aggregate': '0',
'OMPI_MCA_pml': '^ucx',
}