# IT4Innovations 2018

easyblock = "PythonPackage"
name = 'DynaPhoPy'
version = '1.16.3'

homepage = 'https://pypi.python.org/pypi/dynaphopy'
description = 'oftware to calculate crystal microscopic anharmonic properties from molecular dynamics (MD) using the normal-mode-decomposition technique.'

toolchain = {'name': 'Py', 'version': '3.6'}

source_urls = [PYPI_SOURCE]
sources = [SOURCELOWER_TAR_GZ]

dependencies = [
    ('phonopy', '1.12.6.66'),
    ('matplotlib', '2.1.1'),
    ('scipy', '1.0.0'),
    ('h5py', '2.7.1'),
    ('PyYAML', '3.12'),
    ('pyFFTW', '0.10.4'),
]

sanity_check_paths = {'files': [], 'dirs': [
    'lib/python3.6/site-packages/%(namelower)s-%(version)s-py3.6-linux-x86_64.egg'], }

moduleclass = 'python'
