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import distutils.dir_util
import os
import sys
from setuptools import setup
CLASSIFIERS = """\
Development Status :: 4 - Beta
Intended Audience :: Science/Research
Intended Audience :: Developers
License :: OSI Approved :: Apache Software License
Programming Language :: C
Programming Language :: C++
Programming Language :: Python
Programming Language :: Python :: 3
Programming Language :: Python :: 3.5
Programming Language :: Python :: 3.6
Programming Language :: Python :: 3.7
Programming Language :: Python :: 3.8
Programming Language :: Python :: 3.9
Programming Language :: Python :: Implementation :: CPython
Topic :: Software Development
Topic :: Scientific/Engineering :: Chemistry
Operating System :: Microsoft :: Windows
Operating System :: POSIX :: Linux
Operating System :: MacOS
"""
LONG_DESCRIPTION = "Indigo is a universal molecular toolkit that can be used for molecular fingerprinting, substructure search, and molecular visualization.\
Also capable of performing a molecular similarity search, it is 100% open source and provides enhanced stereochemistry support for end users, \
as well as a documented API for developers."
INDIGO_LIBS = None
if sys.argv[1] == "bdist_wheel":
for opt in sys.argv[2:]:
if opt.startswith("--plat-name"):
name = opt.split("=")[1]
if name.startswith("macosx_10_7_intel"):
INDIGO_LIBS = "lib/Mac/10.7/*.dylib"
elif name == "manylinux1_x86_64":
INDIGO_LIBS = "lib/Linux/x64/*.so"
elif name == "manylinux1_i686":
INDIGO_LIBS = "lib/Linux/x86/*.so"
elif name == "win_amd64":
INDIGO_LIBS = "lib/Win/x64/*.dll"
elif name == "win32":
INDIGO_LIBS = "lib/Win/x86/*.dll"
break
if not INDIGO_LIBS:
raise ValueError(
"Wrong --plat-name value! Should be one of: macosx_10_7_intel, manylinux1_x86_64, manylinux1_i686, win_amd64, win32"
)
if os.path.exists("build"):
distutils.dir_util.remove_tree("build")
if os.path.exists("indigo_chem.egg-info"):
distutils.dir_util.remove_tree("indigo_chem.egg-info")
setup(
name="epam.indigo",
version="1.4.2",
description="Indigo universal cheminformatics toolkit",
author="EPAM Systems Life Science Department",
author_email="lifescience.opensource@epam.com",
maintainer="Mikhail Kviatkovskii",
maintainer_email="Mikhail_Kviatkovskii@epam.com",
packages=[
"indigo",
],
license="Apache-2.0",
url="https://lifescience.opensource.epam.com/indigo/index.html",
package_dir={"indigo": "indigo"},
package_data={
"indigo": [
INDIGO_LIBS,
]
},
classifiers=[_f for _f in CLASSIFIERS.split("\n") if _f],
platforms=["Windows", "Linux", "Mac OS-X"],
long_description=LONG_DESCRIPTION,
long_description_content_type="text/plain",
project_urls={
"Bug Tracker": "https://github.com/epam/indigo/issues",
"Documentation": "https://lifescience.opensource.epam.com/indigo/api/index.html",
"Source Code": "https://github.com/epam/indigo/",
},
download_url="https://pypi.org/project/epam.indigo",
)
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