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setup.cfg
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[metadata]
name = turbogenius
author = Kosuke Nakano
author_email = [email protected]
long_description = file: README.md
long_description_content_type = README.md
url = https://github.com/kousuke-nakano/turbogenius
project_urls =
Bug tracker = https://github.com/kousuke-nakano/turbogenius/issues
Documentations = https://github.com/kousuke-nakano/turbotutorials
classifiers =
Intended Audience :: Science/Research
Programming Language :: Python
Programming Language :: Python :: 3.8
Programming Language :: Python :: 3.9
Programming Language :: Python :: 3.10
Programming Language :: Python :: 3.11
License :: OSI Approved :: MIT License
Operating System :: OS Independent
Topic :: Scientific/Engineering :: Mathematics
Topic :: Scientific/Engineering :: Physics
[options]
zip_safe = False
include_package_data = True
packages = find:
python_requires = >=3.8.11
install_requires =
matplotlib >= 3.1.1
numpy >= 1.20.1, < 2
pandas >= 1.2.2
ase >= 3.21.0
trexio >= 1.2.0, <=1.3.2
trexio-tools >= 0.5.0
pymatgen >= 2021.2.16
pytest >= 5.2.1
gitpython >= 3.1.27
pydriller >= 2.1
basis-set-exchange >= 0.9
click >= 8.1.3
tqdm >= 4.36.1
setuptools_scm >= 7.0.5
psutil >= 5.0.0
[options.package_data]
* = *.txt, *.rst
[options.entry_points]
console_scripts =
turbogenius = turbogenius.turbo_genius_cli:cli
trexio-to-turborvb = turbogenius.trexio_to_turborvb:main
[options.packages.find]
exclude =
examples*
tools*
docs*