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setup.py
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import setuptools
with open("README.md", "r") as fh:
long_description = fh.read()
setuptools.setup(
name="biobb_structure_utils",
version="5.0.0",
author="Biobb developers",
author_email="[email protected]",
description="biobb_structure_utils is the Biobb module collection to perform basic manipulations on 3d structures.",
long_description=long_description,
long_description_content_type="text/markdown",
keywords="Bioinformatics Workflows BioExcel Compatibility",
url="https://github.com/bioexcel/biobb_structure_utils",
project_urls={
"Documentation": "http://biobb-structure-utils.readthedocs.io/en/latest/",
"Bioexcel": "https://bioexcel.eu/",
},
packages=setuptools.find_packages(exclude=["docs", "test"]),
package_data={"biobb_structure_utils": ["py.typed"]},
install_requires=["biobb_common==5.0.0", "biobb_structure_checking>=3.13.5"],
python_requires=">=3.9",
entry_points={
"console_scripts": [
"cat_pdb = biobb_structure_utils.utils.cat_pdb:main",
"closest_residues = biobb_structure_utils.utils.closest_residues:main",
"extract_atoms = biobb_structure_utils.utils.extract_atoms:main",
"extract_chain = biobb_structure_utils.utils.extract_chain:main",
"extract_heteroatoms = biobb_structure_utils.utils.extract_heteroatoms:main",
"extract_model = biobb_structure_utils.utils.extract_model:main",
"extract_molecule = biobb_structure_utils.utils.extract_molecule:main",
"extract_residues = biobb_structure_utils.utils.extract_residues:main",
"remove_ligand = biobb_structure_utils.utils.remove_ligand:main",
"remove_molecules = biobb_structure_utils.utils.remove_molecules:main",
"remove_pdb_water = biobb_structure_utils.utils.remove_pdb_water:main",
"renumber_structure = biobb_structure_utils.utils.renumber_structure:main",
"sort_gro_residues = biobb_structure_utils.utils.sort_gro_residues:main",
"str_check_add_hydrogens = biobb_structure_utils.utils.str_check_add_hydrogens:main",
"structure_check = biobb_structure_utils.utils.structure_check:main",
]
},
classifiers=[
"Development Status :: 5 - Production/Stable",
"Programming Language :: Python :: 3.9",
"License :: OSI Approved :: Apache Software License",
"Operating System :: MacOS :: MacOS X",
"Operating System :: POSIX",
"Operating System :: Unix",
],
)