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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
39 lines
1001 B
Plaintext
39 lines
1001 B
Plaintext
# IT$Innovations 2021
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# LK
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easyblock = 'ConfigureMake'
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name = 'arpack-ng'
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version = "3.8.0"
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homepage = 'https://github.com/opencollab/arpack-ng'
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description = """ARPACK is a collection of Fortran77 subroutines designed to solve large scale eigenvalue problems."""
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toolchain = {'name': 'intel', 'version': '2020b'}
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toolchainopts = {'pic': True, 'usempi': True}
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github_account = 'opencollab'
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source_urls = [GITHUB_SOURCE]
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sources = ['%(version)s.tar.gz']
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checksums = ['ada5aeb3878874383307239c9235b716a8a170c6d096a6625bfd529844df003d']
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builddependencies = [
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('Autotools', '20200321'),
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('pkg-config', '0.29.2'),
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]
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dependencies = [
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('Eigen', '3.3.8')
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]
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preconfigopts = "sh bootstrap && "
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configopts = '--enable-mpi --with-pic --with-blas="$LIBBLAS" --with-lapack="$LIBLAPACK"'
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sanity_check_paths = {
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'files': ["lib64/libarpack.la", "lib64/libarpack.%s" % SHLIB_EXT,
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"lib64/libparpack.la", "lib64/libparpack.%s" % SHLIB_EXT],
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'dirs': []
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}
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moduleclass = 'numlib'
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