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setup.py
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setup.py
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#!/usr/bin/env python
from setuptools import setup, find_packages
with open("README.md", "r") as fh:
long_description = fh.read()
version = {}
with open("qed/qed.py") as fp:
exec(fp.read(), version)
setup(
name = "uamc-qed",
version = version['__version__'],
author = "Hans De Winter",
author_email = "[email protected]",
description = ("Python implementation of the QED descriptor (Quantitative Estimation of Druglikeness)"),
long_description = long_description,
long_description_content_type="text/markdown",
url = "https://github.com/UAMCAntwerpen/qed",
download_url = "https://github.com/UAMCAntwerpen/qed/releases/tag/1.0.2",
packages = find_packages(include=['qed']),
keywords = ['uamc', 'qed', 'rdkit', 'cheminformatics'],
classifiers = [
"Development Status :: 5 - Production/Stable",
"Environment :: Console",
"Intended Audience :: Science/Research",
"License :: Freeware",
"Operating System :: POSIX :: Linux",
"Operating System :: MacOS :: MacOS X",
"Programming Language :: Python :: 3",
"Topic :: Scientific/Engineering :: Chemistry",
"Topic :: Software Development :: Libraries :: Python Modules",
],
python_requires = ">=3.6",
)