setup.py

# Copyright 2021 AlQuraishi Laboratory
# Copyright 2021 DeepMind Technologies Limited
#
# Licensed under the Apache License, Version 2.0 (the "License");
# you may not use this file except in compliance with the License.
# You may obtain a copy of the License at
#
#      http://www.apache.org/licenses/LICENSE-2.0
#
# Unless required by applicable law or agreed to in writing, software
# distributed under the License is distributed on an "AS IS" BASIS,
# WITHOUT WARRANTIES OR CONDITIONS OF ANY KIND, either express or implied.
# See the License for the specific language governing permissions and
# limitations under the License.
from setuptools import find_packages
from setuptools import setup

setup(
    name='openfold',
    version='0.1.0',
    description='A PyTorch reimplementation of DeepMind\'s AlphaFold 2',
    author='Gustaf Ahdritz & DeepMind',
    author_email='gahdritz@gmail.com',
    license='Apache License, Version 2.0',
    url='https://github.com/aqlaboratory/openfold',
    packages=find_packages(exclude=["tests", "scripts"]),
    include_package_data=True,
    package_data={"": ["resources/stereo_chemical_props.txt"]},
    install_requires=[
        'torch',
        'deepspeed',
        'biopython',
        'ml-collections',
        'numpy',
        'scipy',
        'pytorch_lightning',
        'dm-tree',
    ],
    classifiers=[
        'License :: OSI Approved :: Apache Software License',
        'Operating System :: POSIX :: Linux',
        'Programming Language :: Python :: 3.7,' 
        'Topic :: Scientific/Engineering :: Artificial Intelligence',
    ],
)