easyconfigs-it4i/h/h5py/h5py-2.10.0-intel-2020b-Python-3.8.6.eb
Lukas Krupcik 747221f326 new file: a/arpack-ng/arpack-ng-3.8.0-intel-2020b.eb
new file:   b/BerkeleyGW/BerkeleyGW-2.1.0-intel-2020b-Python-3.8.6.eb
	new file:   b/BerkeleyGW/BerkeleyGW-2.1.0_missing_file.patch
	new file:   b/BerkeleyGW/BerkeleyGW-2.1.0_tests.patch
	new file:   d/DFTB+/DFTB+-21.1-intel-2020b-Python-3.8.6.eb
	new file:   d/DFTB+/config.cmake-MANUAL-INSTALATION.patch
	new file:   d/dftd3-lib/dftd3-lib-0.9.2-GCC-10.2.0.eb
	new file:   d/dftd3-lib/dftd3-lib-0.9.2_fix-extras-syntax.patch
	new file:   e/ELPA/ELPA-2019.11.001-intel-2020b.eb
	new file:   h/HDF5/HDF5-1.10.6-iimpi-2020b.eb
	new file:   h/h5py/h5py-2.10.0-intel-2020b-Python-3.8.6.eb
	new file:   h/hypothesis/hypothesis-6.13.1-GCC-10.2.0.eb
	new file:   i/impi/impi-2021.2.0-intel-compilers-2021.2.0.eb
	new file:   i/intel-compilers/intel-compilers-2021.2.0.eb
	new file:   n/Newton-X/Newton-X-2.2-B09-intel-2020b.eb
	new file:   n/Newton-X/newton-x-2.2.patch
	new file:   p/pkgconfig/pkgconfig-1.5.1-GCCcore-10.2.0-python.eb
	new file:   p/pybind11/pybind11-2.4.3-GCC-10.2.0-Python-3.8.6.eb
	new file:   p/pybind11/pybind11-2.6.0-GCC-10.2.0-Python-3.8.6.eb
	new file:   s/Schrodinger/Schrodinger_2021-2_Linux-x86_64.eb
	new file:   s/SciPy-bundle/SciPy-bundle-2020.03-intel-2020b-Python-3.8.6.eb
	new file:   s/SciPy-bundle/SciPy-bundle-2021.05-intel-2020b.eb
2021-06-16 07:42:30 +02:00

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# IT4Innovations 2021
# LK
easyblock = 'PythonPackage'
name = 'h5py'
version = '2.10.0'
versionsuffix = '-Python-%(pyver)s'
homepage = 'https://www.h5py.org/'
description = """HDF5 for Python (h5py) is a general-purpose Python interface to the Hierarchical Data Format library,
version 5. HDF5 is a versatile, mature scientific software library designed for the fast, flexible storage of enormous
amounts of data."""
toolchain = {'name': 'intel', 'version': '2020b'}
toolchainopts = {'usempi': True}
source_urls = [PYPI_SOURCE]
sources = [SOURCE_TAR_GZ]
#patches = ['h5py-%(version)s_avoid-mpi-init.patch']
#checksums = [
# '84412798925dc870ffd7107f045d7659e60f5d46d1c70c700375248bf6bf512d', # h5py-2.10.0.tar.gz
# '6bacb71f5d9fbd7bd9a01018d7fe21b067a2317f33c4a7c21fde9cd404c1603f', # h5py-2.10.0_avoid-mpi-init.patch
#]
builddependencies = [('pkgconfig', '1.5.1', versionsuffix)]
dependencies = [
('Python', '3.8.6'),
('SciPy-bundle', '2020.03', versionsuffix),
('HDF5', '1.10.6', '', ('iimpi', '2020b')),
]
use_pip = False
download_dep_fail = True
# to really use mpi enabled hdf5 we now seem to need a configure step, which is the reason we can't use pip
prebuildopts = 'python setup.py configure --mpi --hdf5=$EBROOTHDF5 && '
moduleclass = 'data'