setup.py

from setuptools import setup, find_packages
with open('README.md', 'r', encoding='utf-8') as f:
    long_description = f.read()

__version__ = "Undefined"
for line in open('pyCADD/__init__.py'):
    if line.startswith('__version__'):
        exec(line.strip())

setup(
    name='pyCADD',
    version=__version__,
    author='YH. W',
    author_email='yuhangxmu@stu.xmu.edu.cn',
    description='A Python Package for Computer-aid Drug Design',
    url='https://github.com/CyberCatQ/pyCADD',
    include_package_data=True,
    packages=find_packages(),
    install_requires=['rich>=10.16', 'concurrent_log_handler>=0.9.20',
                      r"scikit-learn", 'pandas>=1.4.1', 
                      'openpyxl', 
                      'pyyaml>=6.0', 'click', 'scipy', 
                      'xlsxwriter>=3.0', 'openpyxl', 'requests'],
    license='GNU General Public License v3.0',
    python_requires='>=3.8',
    long_description=long_description,
    long_description_content_type='text/markdown',
    entry_points={
        'console_scripts': [
            'pyCADD = pyCADD.__main__:main', 
            'pycadd = pyCADD.__main__:main', 
            # 'pycadd-dock = pyCADD.Dock.cli:cli_main',
            'pycadd-dock = pyCADD.utils.env:main',
            'pycadd-density = pyCADD.Density.__main__:main',
            'pycadd-demand = pyCADD.Demand.cli:main',
            'pycadd-dynamic = pyCADD.Dynamic.cli:main'
            ]
    }

)