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setup.py
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setup.py
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try:
from setuptools import setup
except ImportError:
from distutils.core import setup
requirements = [
'e3fp>=1.1',
'sdaxen_python_utilities>=0.1.4',
'scipy>=0.18.0',
'numpy>=1.11.3',
'matplotlib>=2.0.0',
'networkx>=1.11',
'nolearn>=0.6.0',
'pandas>=0.18.1',
'pygraphviz>=1.3.1',
'scikit-learn>=0.18.0',
'seaborn>=0.7.1'
]
classifiers = ['Programming Language :: Python',
'Programming Language :: Python :: 2 :: Only',
'Programming Language :: Python :: 2.7',
'License :: OSI Approved :: GNU Lesser General Public License v3 (LGPLv3)',
'Operating System :: OS Independent',
'Development Status :: 4 - Beta',
'Intended Audience :: Science/Research',
'Intended Audience :: Developers',
'Topic :: Scientific/Engineering :: Chemistry',
'Topic :: Software Development :: Libraries :: Python Modules'
]
setup(
name='e3fp_paper',
packages=['e3fp_paper', 'e3fp_paper.crossvalidation',
'e3fp_paper.plotting', 'e3fp_paper.sea_utils'],
version='1.1',
description='E3FP paper library and repo',
keywords='e3fp 3d molecule fingerprint conformer paper',
author='Seth Axen',
author_email='[email protected]',
license='LGPLv3',
url='https://github.com/keiserlab/e3fp-paper',
classifiers=classifiers,
download_url='https://github.com/keiserlab/e3fp-paper/tarball/1.1',
install_requires=requirements,
include_package_data=True
)