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setup.cfg
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setup.cfg
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[tool.setuptools_scm]
write_to = "sympleints/version.py"
[metadata]
name = sympleints
description = Molecular integrals over Gaussian basis functions using sympy.
long_description = file: README.md
long_description_content_type = text/markdown
url = https://github.com/eljost/sympleints
maintainer = Johannes Steinmetzer
maintainer_email = johannes.steinmetzer@uni-jena.de
license = GNU General Public License v3 (GPLv3)
platform = unix
classifiers =
License :: OSI Approved :: GNU General Public License v3 (GPLv3)
[options]
packages = find:
include_package_data = True
python_requires = >=3.8
install_requires =
black
colorama
fprettify
jinja2
matplotlib
networkx
numpy
pathos
psutil
pytest
sympy
[options.entry_points]
console_scripts =
sympleints = sympleints.main:run_cli
sympleints-graph = sympleints.graphs.main:run
symplebench = sympleints.benchmark:run