{toolchain} gobff/2020b (toolchain with BLIS + libFLAME)

easybuild/easyconfigs/b/BLIS/BLIS-0.8.0-GCC-10.2.0.eb

@@ -0,0 +1,30 @@
+easyblock = 'ConfigureMake'
+
+name = 'BLIS'
+version = '0.8.0'
+
+homepage = 'https://github.com/flame/blis/'
+description = """BLIS is a portable software framework for instantiating high-performance
+BLAS-like dense linear algebra libraries."""
+
+toolchain = {'name': 'GCC', 'version': '10.2.0'}
+
+source_urls = ['https://github.com/flame/blis/archive/']
+sources = ['%(version)s.tar.gz']
+checksums = ['5e05868c4a6cf5032a7492f8861653e939a8f907a4fa524bbb6e14394e170a3d']
+
+builddependencies = [('Python', '3.8.6')]
+
+configopts = '--enable-cblas --enable-threading=openmp --enable-shared CC="$CC" auto'
+
+runtest = 'check'
+
+sanity_check_paths = {
+    'files': ['include/blis/cblas.h', 'include/blis/blis.h',
+              'lib/libblis.a', 'lib/libblis.%s' % SHLIB_EXT],
+    'dirs': [],
+}
+
+modextrapaths = {'CPATH': 'include/blis'}
+
+moduleclass = 'numlib'

easybuild/easyconfigs/g/gobff/gobff-2020b.eb

@@ -0,0 +1,31 @@
+easyblock = "Toolchain"
+
+name = 'gobff'
+version = '2020b'
+
+homepage = '(none)'
+description = 'GCC and GFortran based compiler toolchain with OpenMPI, BLIS, libFLAME, ScaLAPACK and FFTW.'
+
+toolchain = SYSTEM
+
+local_comp_name = 'GCC'
+local_comp_version = '10.2.0'
+local_comp = (local_comp_name, local_comp_version)
+local_blisver = '0.8.0'
+local_libflamever = '5.2.0'
+
+# toolchain used to build  dependencies
+local_comp_mpi_tc_name = 'gompi'
+local_comp_mpi_tc = (local_comp_mpi_tc_name, version)
+
+# compiler toolchain dependencies
+dependencies = [
+    local_comp,
+    ('OpenMPI', '4.0.5', '', local_comp),  # part of gompi toolchain
+    ('BLIS', local_blisver, '', local_comp),
+    ('libFLAME', local_libflamever, '', local_comp),
+    ('ScaLAPACK', '2.1.0', '-bf', local_comp_mpi_tc),
+    ('FFTW', '3.3.8', '', local_comp_mpi_tc),
+]
+
+moduleclass = 'toolchain'

easybuild/easyconfigs/h/HPL/HPL-2.3-gobff-2020b.eb

@@ -0,0 +1,21 @@
+name = 'HPL'
+version = '2.3'
+
+homepage = 'https://www.netlib.org/benchmark/hpl/'
+description = """HPL is a software package that solves a (random) dense linear system in double precision (64 bits)
+ arithmetic on distributed-memory computers. It can thus be regarded as a portable as well as freely available
+ implementation of the High Performance Computing Linpack Benchmark."""
+
+toolchain = {'name': 'gobff', 'version': '2020b'}
+toolchainopts = {'usempi': True}
+
+source_urls = ['https://www.netlib.org/benchmark/%(namelower)s']
+sources = [SOURCELOWER_TAR_GZ]
+# fix Make dependencies, so parallel build also works
+patches = ['HPL_parallel-make.patch']
+checksums = [
+    '32c5c17d22330e6f2337b681aded51637fb6008d3f0eb7c277b163fadd612830',  # hpl-2.3.tar.gz
+    '2a5bf9c4f328049828ddecec7ba3f05a9e25d236f4212747c53bd22fea80c5e6',  # HPL_parallel-make.patch
+]
+
+moduleclass = 'tools'

easybuild/easyconfigs/l/libFLAME/libFLAME-5.2.0-GCC-10.2.0.eb

@@ -0,0 +1,53 @@
+easyblock = 'ConfigureMake'
+
+name = 'libFLAME'
+version = '5.2.0'
+
+homepage = 'https://developer.amd.com/amd-cpu-libraries/blas-library/#libflame'
+description = """libFLAME is a portable library for dense matrix computations,
+providing much of the functionality present in LAPACK."""
+
+toolchain = {'name': 'GCC', 'version': '10.2.0'}
+toolchainopts = {'pic': True}
+
+source_urls = ['https://github.com/flame/libflame/archive/']
+sources = ['%(version)s.tar.gz']
+checksums = ['997c860f351a5c7aaed8deec00f502167599288fd0559c92d5bfd77d0b4d475c']
+
+# '--enable-max-arg-list-hack --enable-dynamic-build' requires 'file' function from GNU Make 4.x
+builddependencies = [
+    ('binutils', '2.35'),
+    ('Python', '3.8.6'),
+    ('make', '4.3'),  # needed on Cent OS 7  where make 3 is installed
+]
+
+dependencies = [('BLIS', '0.8.0')]
+
+# Use unset FLIBS to let configure pick up LDFLAGS
+preconfigopts = 'unset FLIBS && '
+preconfigopts += 'LIBS="-lblis $LIBS" '
+preconfigopts += 'LDFLAGS="$LDFLAGS -L$EBROOTBLIS/lib -fopenmp -lm -lpthread" '
+preconfigopts += 'CFLAGS="$CFLAGS -I$EBROOTBLIS/include/blis" '
+
+configopts = '--enable-max-arg-list-hack '
+configopts += '--enable-lapack2flame '
+configopts += '--enable-external-lapack-interfaces '
+configopts += '--enable-cblas-interfaces '
+configopts += '--enable-dynamic-build '
+configopts += '--enable-multithreading=openmp '
+
+# libFLAME C++ Template API tests
+# runtest = 'checkcpp LIBBLAS=$EBROOTBLIS/lib/libblis.a'
+
+# sanity_check_commands = [
+#     'cd %(builddir)s/%(namelower)s-%(version)s/test '
+#     '&& make LIBBLAS=$EBROOTBLIS/lib/libblis-mt.so LDFLAGS="-fopenmp -lm -lpthread" '
+#     '&& ./test_libfame.x'
+# ]
+
+sanity_check_paths = {
+    'files': ['include/FLAME.h', 'lib/libflame.a', 'lib/libflame.%s' % SHLIB_EXT],
+    'dirs': ['lib'],
+}
+
+moduleclass = 'numlib'

easybuild/easyconfigs/m/make/make-4.3-GCC-10.2.0.eb

@@ -0,0 +1,41 @@
+##
+# This file is an EasyBuild recipy as per https://github.com/easybuilders/easybuild
+#
+# Copyright:: Copyright 2012-2014 Uni.Lu/LCSB, NTUA
+# Authors::   Fotis Georgatos <[email protected]>
+# License::   MIT/GPL
+# $Id$
+#
+# This work implements a part of the HPCBIOS project and is a component of the policy:
+# http://hpcbios.readthedocs.org/en/latest/
+##
+easyblock = 'ConfigureMake'
+
+name = 'make'
+version = '4.3'
+
+homepage = 'https://www.gnu.org/software/make/make.html'
+description = "GNU version of make utility"
+
+toolchain = {'name': 'GCC', 'version': '10.2.0'}
+
+
+source_urls = [GNU_SOURCE]
+sources = [SOURCE_TAR_GZ]
+checksums = ['e05fdde47c5f7ca45cb697e973894ff4f5d79e13b750ed57d7b66d8defc78e19']
+
+builddependencies = [('binutils', '2.35')]
+
+postinstallcmds = ["cd %(installdir)s/bin && ln -s make gmake"]
+
+sanity_check_paths = {
+    'files': ['bin/gmake', 'bin/make'],
+    'dirs': []
+}
+
+sanity_check_commands = [
+    "gmake --help",
+    "make --help",
+]
+
+moduleclass = 'devel'

easybuild/easyconfigs/s/ScaLAPACK/ScaLAPACK-2.1.0-gompi-2020b-bf.eb

@@ -0,0 +1,44 @@
+name = 'ScaLAPACK'
+version = '2.1.0'
+versionsuffix = '-bf'
+
+homepage = 'https://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': 'gompi', 'version': '2020b'}
+toolchainopts = {'pic': True}
+
+source_urls = [homepage]
+sources = [SOURCELOWER_TGZ]
+patches = ['ScaLAPACK-%(version)s_fix-GCC-10.patch']
+checksums = [
+    '61d9216cf81d246944720cfce96255878a3f85dec13b9351f1fa0fd6768220a6',  # scalapack-2.1.0.tgz
+    'bbb713c9fcabac802811c7f2c3a957c2d5d19dfd118ed1f6578c1436b82c7c43',  # ScaLAPACK-2.1.0_fix-GCC-10.patch
+]
+
+builddependencies = [
+    ('CMake', '3.18.4'),
+]
+
+dependencies = [
+    ('BLIS', '0.8.0'),
+    ('libFLAME', '5.2.0'),
+]
+
+# Config Opts based on AOCL User Guide:
+# https://developer.amd.com/wp-content/resources/AOCL_User%20Guide_2.2.pdf
+
+configopts = '-DBUILD_SHARED_LIBS=ON '
+configopts += '-DBLAS_LIBRARIES="$EBROOTBLIS/lib/libblis.a" '
+configopts += '-DLAPACK_LIBRARIES="$EBROOTLIBFLAME/lib/libflame.a" '
+configopts += '-DCMAKE_C_COMPILER=mpicc '
+configopts += '-DCMAKE_Fortran_COMPILER=mpif90 '
+configopts += '-DCMAKE_Fortran_FLAGS="-lpthread -fopenmp $DCMAKE_Fortran_FLAGS" '
+
+sanity_check_paths = {
+    'files': ['lib/libscalapack.%s' % SHLIB_EXT, 'lib64/libscalapack.%s' % SHLIB_EXT],
+    'dirs': ["lib", "lib64"],
+}
+
+moduleclass = 'numlib'

test/easyconfigs/easyconfigs.py

@@ -222,6 +222,12 @@ def check_dep_vars(self, dep, dep_vars):
             if len(blis_vsuff_vars) == 1:
                 dep_vars = dict((k, v) for (k, v) in dep_vars.items() if k != blis_vsuff_vars[0])
 
+        # filter out ScaLAPACK with -bf versionsuffix, used in gobff toolchain
+        if dep == 'ScaLAPACK':
+            bf_vsuff_vars = [v for v in dep_vars.keys() if '; versionsuffix: -bf' in v]
+            if len(bf_vsuff_vars) == 1:
+                dep_vars = dict((k, v) for (k, v) in dep_vars.items() if k != bf_vsuff_vars[0])
+
         # for some dependencies, we allow exceptions for software that depends on a particular version,
         # as long as that's indicated by the versionsuffix
         if dep in ['ASE', 'Boost', 'Java', 'Lua', 'PLUMED', 'PyTorch', 'R', 'TensorFlow'] and len(dep_vars) > 1: