sympleints/pyproject.toml at main · eljost/sympleints · GitHub

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[build-system]
build-backend = "mesonpy"
requires = ["meson-python", "wheel"]

[project]
name = "sympleints"
version = "0.0.2"
description = "Molecular integrals over Gaussian basis functions using sympy."
readme = "README.md"
license = { file = "LICENSE" }
classifiers = [
    "License :: OSI Approved :: EUROPEAN UNION PUBLIC LICENCE v. 1.2 (EUPL-1.2)"
]
maintainers = [{ name = "Johannes Steinmetzer", email="johannes.steinmetzer@uni-jena.de" }]
authors = [{ name = "Johannes Steinmetzer", email="johannes.steinmetzer@uni-jena.de" }]
requires-python = ">= 3.8"
dependencies = [
    "black",
    "colorama",
    "fprettify",
    "jinja2",
    "matplotlib",
    "networkx",
    "numpy",
    "pathos",
    "psutil",
    "sympy",
]

[project.optional-dependencies]
test = ["pyscf", "pytest", "pytest-cov"]

[project.urls]
Repository = "https://github.com/eljost/sympleints"

[project.scripts]
sympleints = "sympleints.main:run_cli"
sympleints-graph = "sympleints.graphs.main:run"


[tool.pyright]
exclude = ["tests/**"]

[tool.ruff]
ignore-init-module-imports = true