{toolchain}[dummy/dummy] goolfc v2017b

easybuild/easyconfigs/c/CUDA/CUDA-9.0.176-GCC-6.4.0-2.28.eb

@@ -0,0 +1,22 @@
+name = 'CUDA'
+version = '9.0.176'
+nv_version = '384.81'
+
+homepage = 'https://developer.nvidia.com/cuda-toolkit'
+description = """CUDA (formerly Compute Unified Device Architecture) is a parallel
+ computing platform and programming model created by NVIDIA and implemented by the
+ graphics processing units (GPUs) that they produce. CUDA gives developers access
+ to the virtual instruction set and memory of the parallel computational elements in CUDA GPUs."""
+
+toolchain = {'name': 'GCC', 'version': '6.4.0-2.28'}
+
+source_urls = [
+    'https://developer.nvidia.com/compute/cuda/%(version_major_minor)s/prod/local_installers/',
+    'http://developer.download.nvidia.com/compute/cuda/%(version_major_minor)s/Prod/local_installers/',
+    'https://developer.nvidia.com/compute/cuda/%(version_major_minor)s/Prod2/local_installers/',
+    'https://developer.nvidia.com/compute/%(namelower)s/%(version_major_minor)s/Prod/local_installers/',
+]
+sources = ['%%(namelower)s_%%(version)s_%s_linux-run' % nv_version]
+checksums = ['96863423feaa50b5c1c5e1b9ec537ef7ba77576a3986652351ae43e66bcd080c']
+
+moduleclass = 'system'

easybuild/easyconfigs/f/FFTW/FFTW-3.3.6-gompic-2017b.eb

@@ -0,0 +1,17 @@
+name = 'FFTW'
+version = '3.3.6'
+
+homepage = 'http://www.fftw.org'
+description = """FFTW is a C subroutine library for computing the discrete Fourier transform (DFT)
+ in one or more dimensions, of arbitrary input size, and of both real and complex data."""
+
+toolchain = {'name': 'gompic', 'version': '2017b'}
+toolchainopts = {'pic': True}
+
+source_urls = [homepage]
+sources = ['fftw-%(version)s-pl2.tar.gz']
+checksums = ['a5de35c5c824a78a058ca54278c706cdf3d4abba1c56b63531c2cb05f5d57da2']
+
+runtest = 'check'
+
+moduleclass = 'numlib'

easybuild/easyconfigs/g/gcccuda/gcccuda-2017b.eb

@@ -0,0 +1,21 @@
+easyblock = "Toolchain"
+
+name = 'gcccuda'
+version = '2017b'
+
+homepage = '(none)'
+description = """GNU Compiler Collection (GCC) based compiler toolchain, along with CUDA toolkit."""
+
+toolchain = {'name': 'dummy', 'version': 'dummy'}
+
+comp_name = 'GCC'
+comp_ver = '6.4.0-2.28'
+comp = (comp_name, comp_ver)
+
+# compiler toolchain dependencies
+dependencies = [
+    comp,
+    ('CUDA', '9.0.176', '', comp),
+]
+
+moduleclass = 'toolchain'

easybuild/easyconfigs/g/gompic/gompic-2017b.eb

@@ -0,0 +1,23 @@
+easyblock = "Toolchain"
+
+name = 'gompic'
+version = '2017b'
+
+homepage = '(none)'
+description = """GNU Compiler Collection (GCC) based compiler toolchain along with CUDA toolkit,
+ including OpenMPI for MPI support with CUDA features enabled."""
+
+toolchain = {'name': 'dummy', 'version': 'dummy'}
+
+comp_name = 'GCC'
+comp_ver = '6.4.0-2.28'
+comp = (comp_name, comp_ver)
+
+# compiler toolchain dependencies
+dependencies = [
+    comp,  # part of gcccuda
+    ('CUDA', '9.0.176', '', comp),  # part of gcccuda
+    ('OpenMPI', '2.1.1', '', ('gcccuda', version)),
+]
+
+moduleclass = 'toolchain'

easybuild/easyconfigs/g/goolfc/goolfc-2017b.eb

@@ -0,0 +1,37 @@
+easyblock = "Toolchain"
+
+name = 'goolfc'
+version = '2017b'
+
+homepage = '(none)'
+description = """GCC based compiler toolchain __with CUDA support__, and including
+ OpenMPI for MPI support, OpenBLAS (BLAS and LAPACK support), FFTW and ScaLAPACK."""
+
+toolchain = {'name': 'dummy', 'version': 'dummy'}
+
+comp_name = 'GCC'
+comp_ver = '6.4.0-2.28'
+comp = (comp_name, comp_ver)
+
+# toolchain used to build goolfc dependencies
+comp_mpi_tc_name = 'gompic'
+comp_mpi_tc_ver = version
+comp_mpi_tc = (comp_mpi_tc_name, comp_mpi_tc_ver)
+
+blaslib = 'OpenBLAS'
+blasver = '0.2.20'
+blas = '-%s-%s' % (blaslib, blasver)
+
+# compiler toolchain dependencies
+# we need GCC and OpenMPI as explicit dependencies instead of gompi toolchain
+# because of toolchain preperation functions
+dependencies = [
+    comp,  # part of gompic
+    ('CUDA', '9.0.176', '', comp),  # part of gompic
+    ('OpenMPI', '2.1.1', '', ('gcccuda', version)),  # part of gompic
+    (blaslib, blasver, '', comp),
+    ('FFTW', '3.3.6', '', comp_mpi_tc),
+    ('ScaLAPACK', '2.0.2', blas, comp_mpi_tc),
+]
+
+moduleclass = 'toolchain'

easybuild/easyconfigs/o/OpenMPI/OpenMPI-2.1.1-gcccuda-2017b.eb

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+easyblock = 'ConfigureMake'
+
+name = 'OpenMPI'
+version = '2.1.1'
+
+homepage = 'http://www.open-mpi.org/'
+description = """The Open MPI Project is an open source MPI-2 implementation."""
+
+toolchain = {'name': 'gcccuda', 'version': '2017b'}
+
+source_urls = ['http://www.open-mpi.org/software/ompi/v%(version_major_minor)s/downloads']
+sources = [SOURCELOWER_TAR_GZ]
+checksums = ['afe4bef3c4378bc76eea96c623d5aa4c1c98b9e057d281c646e68869292a77dc']
+
+dependencies = [('hwloc', '1.11.7')]
+
+configopts = '--enable-shared --enable-mpi-thread-multiple --with-verbs '
+configopts += '--enable-mpirun-prefix-by-default '  # suppress failure modes in relation to mpirun path
+configopts += '--with-hwloc=$EBROOTHWLOC '  # hwloc support
+configopts += '--with-cuda=$CUDA_HOME '     # CUDA-aware build; N.B. --disable-dlopen is incompatible
+
+# to enable SLURM integration (site-specific)
+# configopts += '--with-slurm --with-pmi=/usr/include/slurm --with-pmi-libdir=/usr'
+
+# needed for --with-verbs
+osdependencies = [('libibverbs-dev', 'libibverbs-devel', 'rdma-core-devel')]
+
+libs = ["mpi_mpifh", "mpi", "ompitrace", "open-pal", "open-rte"]
+sanity_check_paths = {
+    'files': ["bin/%s" % binfile for binfile in ["ompi_info", "opal_wrapper", "orterun"]] +
+             ["lib/lib%s.%s" % (libfile, SHLIB_EXT) for libfile in libs] +
+             ["include/%s.h" % x for x in ["mpi-ext", "mpif-config", "mpif", "mpi", "mpi_portable_platform"]],
+    'dirs': [],
+}
+
+moduleclass = 'mpi'

easybuild/easyconfigs/s/ScaLAPACK/ScaLAPACK-2.0.2-gompic-2017b-OpenBLAS-0.2.20.eb

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+name = 'ScaLAPACK'
+version = '2.0.2'
+
+homepage = 'http://www.netlib.org/scalapack/'
+description = """The ScaLAPACK (or Scalable LAPACK) library includes a subset of LAPACK routines
+ redesigned for distributed memory MIMD parallel computers."""
+
+toolchain = {'name': 'gompic', 'version': '2017b'}
+toolchainopts = {'pic': True}
+
+source_urls = [homepage]
+sources = [SOURCELOWER_TGZ]
+checksums = ['0c74aeae690fe5ee4db7926f49c5d0bb69ce09eea75beb915e00bba07530395c']
+
+blaslib = 'OpenBLAS'
+blasver = '0.2.20'
+
+versionsuffix = "-%s-%s" % (blaslib, blasver)
+
+dependencies = [(blaslib, blasver, '', ('GCC', '6.4.0-2.28'))]
+
+moduleclass = 'numlib'