setup.py

#!/usr/bin/env python
# -*- coding: utf-8 -*-
#
# Jérôme Eberhardt 2016-2020
# Author: Jérôme Eberhardt <qksonoe@gmail.com>
#
# License: MIT

from os.path import realpath, dirname, join
from setuptools import setup, find_packages


PROJECT_ROOT = dirname(realpath(__file__))
REQUIREMENTS_FILE = join(PROJECT_ROOT, 'requirement.txt')

with open(REQUIREMENTS_FILE) as f:
    install_reqs = f.read().splitlines()
install_reqs.append('setuptools')

with open('README.md', 'r') as fh:
    long_description = fh.read()

setup(name='unrolr',
      version='0.5.0.3',
      author='Jérôme Eberhardt',
      author_email='qksoneo@gmail.com',
      description='Dimensionality reduction method for MD trajectories',
      long_description=long_description,
      long_description_content_type='text/markdown',
      packages=find_packages(),
      package_data={'': ['LICENSE',
                         'README.md',
                         'requirement.txt']
                   },
      data_files = [('', ['unrolr/core/kernel.cl'])],
      install_requires=install_reqs,
      include_package_data=True,
      zip_safe=False,
      license='MIT',
      keywords=['bioinformatics', 'molecular structures',
               'molecular dynamics', 'OpenCL',
               'dimensionality reduction', 'stochastic proximity embedding',
               'dihedral angles'],
      classifiers=[
            'License :: OSI Approved :: MIT License',
            'Programming Language :: Python :: 3.6',
            'Programming Language :: Python :: 3.7',
            'Programming Language :: Python :: 3.8',
            'Operating System :: Unix',
            'Operating System :: MacOS',
            'Topic :: Scientific/Engineering'
      ]
      )