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setup.py
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from setuptools import setup, find_packages
from mol2vec import __version__
setup(name='mol2vec',
version=__version__,
description='Mol2vec - an unsupervised machine learning approach to learn vector representations of molecular \
substructures',
classifiers=[
'Development Status :: 3 - Alpha',
'License :: OSI Approved :: BSD 3-clause',
'Programming Language :: Python :: 3.6',
'Topic :: Cheminformatics :: Featurization',
],
url='http://github.com/samoturk/mol2vec',
author='Samo Turk, Sabrina Jaeger, Simone Fulle',
license='BSD 3-clause',
packages=find_packages(),
install_requires=['numpy', 'gensim', 'tqdm', 'joblib', 'pandas', 'matplotlib', 'IPython', 'seaborn'],
zip_safe=False,
entry_points="""
[console_scripts]
mol2vec=mol2vec.app.mol2vec:run
"""
)