from setuptools import setup

setup(

    name="ddc_pub",

    version="0.3",

    description="Neural network to encode/decode molecules.",

    url="https://github.com/pcko1/Deep-Drug-Coder",

    author="Panagiotis-Christos Kotsias",

    author_email="kotsias.pan@gmail.com",

    license="MIT",

    packages=["ddc_pub"],

    install_requires=[

        "numpy          == 1.16.5",

        "h5py           == 2.9.0",

        "tensorflow-gpu == 2.0.0",

        "tqdm           == 4.35.0",

        "scikit-learn   == 0.21.3",

        "scipy          == 1.3.1",

        "ipykernel      == 5.1.1",

        "ipython",

        "matplotlib     == 3.1.1",

        "pandas         == 0.25.1",

    "molsets        == 0.2"

    ],

    zip_safe=False,

)