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setup.cfg
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setup.cfg
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[metadata]
name = Auto3D
version = 2.3.1
author = 'Zhen Liu, Tetiana Zubatiuk, Adrian Roitberg, Olexandr Isayev'
description = Generating Low-energy 3D Conformers from SMILES/SDF
long_description = file: README.md
long_description_content_type = text/markdown
url = https://github.com/isayevlab/Auto3D_pkg
project_urls =
Bug Tracker = https://github.com/isayevlab/Auto3D_pkg/issues
classifiers =
Programming Language :: Python :: 3
License :: OSI Approved :: MIT License
Operating System :: OS Independent
[options]
package_dir =
= src
packages = find:
python_requires = >=3.7
include_package_data = True
#...
install_requires =
tqdm
psutil
Send2Trash
pyyaml
[options.packages.find]
where = src
[options.entry_points]
console_scripts =
auto3d = Auto3D.auto3Dcli:cli