easyblock = 'PythonBundle'

name = 'SciPy-bundle'
version = '2021.10'

homepage = 'https://python.org/'
description = "Bundle of Python packages for scientific software"

toolchain = {'name': 'OAMD', 'version': '2021a'}
toolchainopts = {'pic': True, 'lowopt': True}

builddependencies = [
    ('hypothesis', '6.14.6', '', ('GCCcore', '10.2.0')),
    ('UnZip', '6.0', '', ('GCCcore', '10.2.0')),
]

dependencies = [
    ('Python', '3.8.6', '', ('GCCcore', '10.2.0')),
    ('pybind11', '2.7.1', '', ('GCCcore','10.2.0')),  # required by scipy
]

use_pip = True

preconfigopts = [ 'export MKL_DEBUG_CPU_TYPE=5 && ']
#exts_default_options = {'source_urls': [PYPI_SOURCE]}

# order is important!
exts_list = [
    ('numpy', '1.21.3', {
        'sources': ['%(name)s-%(version)s.zip'],
        'patches': ['numpy-1.20.3_skip-ppc-long-complex-test.patch'],
        'checksums': [
            '63571bb7897a584ca3249c86dd01c10bcb5fe4296e3568b2e9c1a55356b6410e',  # numpy-1.21.3.zip
            # numpy-1.20.3_skip-ppc-long-complex-test.patch
            '2f9a12e3a352b39076db84a7622fc8f4796abd3cb7f97f71958a495e864659a4',
        ],
    }),
    ('ply', '3.11', {
        'checksums': ['00c7c1aaa88358b9c765b6d3000c6eec0ba42abca5351b095321aef446081da3'],
    }),
    ('gast', '0.5.2', {
        'checksums': ['f81fcefa8b982624a31c9e4ec7761325a88a0eba60d36d1da90e47f8fe3c67f7'],
    }),
    ('beniget', '0.4.1', {
        'checksums': ['75554b3b8ad0553ce2f607627dad3d95c60c441189875b98e097528f8e23ac0c'],
    }),
    ('pythran', '0.10.0', {
        'checksums': ['9dac8e1d50f33d4676003e350b1f0c878ce113e6f907920e92dc103352cac5bf'],
    }),
    ('scipy', '1.7.1', {
        'checksums': ['6b47d5fa7ea651054362561a28b1ccc8da9368a39514c1bbf6c0977a1c376764'],
    }),
    ('mpi4py', '3.1.1', {
        'checksums': ['e11f8587a3b93bb24c8526addec664b586b965d83c0882b884c14dc3fd6b9f5c'],
    }),
    ('numexpr', '2.7.3', {
        'checksums': ['43616529f9b7d1afc83386f943dc66c4da5e052f00217ba7e3ad8dd1b5f3a825'],
    }),
    ('Bottleneck', '1.3.2', {
        'checksums': ['20179f0b66359792ea283b69aa16366419132f3b6cf3adadc0c48e2e8118e573'],
    }),
    ('pandas', '1.3.4', {
        'preinstallopts': """sed -i 's@extra_compile_args = \["-Werror"\]@extra_compile_args = []@g' setup.py && """,
        'checksums': ['a2aa18d3f0b7d538e21932f637fbfe8518d085238b429e4790a35e1e44a96ffc'],
    }),
    ('mpmath', '1.2.1', {
        'checksums': ['79ffb45cf9f4b101a807595bcb3e72e0396202e0b1d25d689134b48c4216a81a'],
    }),
    ('deap', '1.3.1', {
        'checksums': ['11f54493ceb54aae10dde676577ef59fc52d52f82729d5a12c90b0813c857a2f'],
    }),
]

sanity_pip_check = True

moduleclass = 'lang'