geomm/setup.py at master · ADicksonLab/geomm · GitHub

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#!/usr/bin/env python


import io
import re
from glob import glob
from os.path import basename
from os.path import dirname
from os.path import join
from os.path import splitext

from setuptools import setup, find_packages

import itertools as it

# package specific imports
from Cython.Build import cythonize
import numpy as np

# the basic needed requirements for a package
base_requirements = [
    'numpy',
    'scipy',
    'pint'
]

# extras requirements list

# SNIPPET: example extra requirement
# example_extra_requirements = ['requests']
# extras = [example_extra_requirements,]

# Add your extra requirements lists here:
extras = [
]

# combination of all the extras requirements
_all_requirements = [[base_requirements]] + extras
all_requirements = it.chain.from_iterable(_all_requirements)

setup(
    name='geomm',
    version='0.3',
    author="Samuel D. Lotz",
    author_email="samuel.lotz@salotz.info",
    description="A simple no-nonsense library for computing common geometry on macromolecular systems.",
    #long_description=open('README.org').read(),
    license="MIT",
    url="https://github.com/ADicksonLab/geomm",
    classifiers=[
        "Topic :: Utilities",
        "License :: OSI Approved :: MIT License",
        'Programming Language :: Python :: 3'
    ],

    keywords='geometry chemistry macromolecules protein structural-informatics',
    # building/dev
    setup_requires=[
        'pytest-runner',
        'numpy',
        'cython',
    ],
    tests_require=['pytest', 'tox'],

    include_dirs=[np.get_include()],
    ext_modules = cythonize("src/geomm/pyqcprot.pyx"),


    # package
    packages=find_packages(where='src'),

    package_dir={'' : 'src'},

    # if this is true then the package_data won't be included in the
    # dist. Use MANIFEST.in for this
    include_package_data=True,

    # pymodules is for single file standalone modules not part of the
    # package
    py_modules=[splitext(basename(path))[0] for path in glob('src/*.py')],

    install_requires=base_requirements,

    # SNIPPET: example of using extra requirements
    # extras_require={
    #     'extras' : example_extra_requirements
    #     'all' : all_requirements,
    # }

    # include your extra requirement sets here
    extras_require={
        'all' : all_requirements,
    }
)