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setup.py
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setup.py
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#!/usr/bin/env python
import os
from setuptools import setup, find_packages
module_dir = os.path.dirname(os.path.abspath(__file__))
if __name__ == "__main__":
setup(
name='atomate',
version='0.6.8',
description='atomate has implementations of FireWorks workflows for '
'Materials Science',
long_description=open(os.path.join(module_dir, 'README.md')).read(),
url='https://github.com/hackingmaterials/atomate',
author='Anubhav Jain, Kiran Mathew',
author_email='[email protected], [email protected]',
license='modified BSD',
packages=find_packages(),
package_data={'atomate.vasp.workflows.base': ['library/*']},
zip_safe=False,
install_requires=['FireWorks>=1.4.0', 'pymatgen>=2017.12.15',
'custodian>=2017.12.23', 'monty>=1.0.2',
'tqdm>=4.7.4', 'six',
'pymatgen-diffusion>=2018.1.4'],
extras_require={'rtransfer': ['paramiko>=1.15.0'],
'plotting': ['matplotlib>=1.5.2'],
'phonons': ['phonopy>=1.10.8'],
'complete': ['paramiko>=1.15.0',
'matplotlib>=1.5.2',
'phonopy>=1.10.8',
'boltons>=17.2.0',
]},
classifiers=['Programming Language :: Python :: 2.7',
"Programming Language :: Python :: 3",
"Programming Language :: Python :: 3.6",
'Development Status :: 5 - Production/Stable',
'Intended Audience :: Science/Research',
'Intended Audience :: System Administrators',
'Intended Audience :: Information Technology',
'Operating System :: OS Independent',
'Topic :: Other/Nonlisted Topic',
'Topic :: Scientific/Engineering'],
test_suite='nose.collector',
tests_require=['nose'],
scripts=[os.path.join('scripts', f) for f in os.listdir(os.path.join(module_dir, 'scripts'))]
)