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pyproject.toml
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pyproject.toml
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[build-system]
requires = [
"setuptools>=61.2",
"versioningit",
]
build-backend = "setuptools.build_meta"
[project]
name = "gufe"
description = ""
readme = "README.md"
authors = [{name = "The OpenFE developers", email = "[email protected]"}]
license = {text = "MIT"}
classifiers = [
"Development Status :: 1 - Planning",
"Intended Audience :: Science/Research",
"License :: OSI Approved :: MIT License",
"Operating System :: POSIX",
"Operating System :: Microsoft :: Windows",
"Programming Language :: Python :: 3",
"Topic :: Scientific/Engineering :: Bio-Informatics",
"Topic :: Scientific/Engineering :: Chemistry",
]
urls = {Homepage = "https://github.com/OpenFreeEnergy/gufe"}
requires-python = ">= 3.10"
dependencies = [
"numpy",
"networkx",
]
dynamic = ["version"]
[project.optional-dependencies]
test = [
"pytest",
"pytest-xdist",
]
[tool.setuptools]
zip-safe = false
include-package-data = true
license-files = ["LICENSE"]
[tool.setuptools.packages]
find = {namespaces = false}
[tool.mypy]
files = "gufe"
ignore_missing_imports = true
[[tool.mypy.overrides]]
module = "gufe.vendor.*"
ignore_errors = true
[tool.coverage.run]
omit = [
"*/_version.py",
"*/tests/dev/*py",
"gufe/tests/*",
"gufe/vendor/*",
]
[tool.coverage.report]
exclude_lines = [
"pragma: no cover",
"pragma: no-cover",
"-no-cov",
"raise NotImplementedError",
'\.\.\.',
]
[tool.versioningit]
default-version = "1+unknown"
[tool.versioningit.format]
distance = "{base_version}+{distance}.{vcs}{rev}"
dirty = "{base_version}+{distance}.{vcs}{rev}.dirty"
distance-dirty = "{base_version}+{distance}.{vcs}{rev}.dirty"
[tool.versioningit.vcs]
method = "git"
match = ["*"]
default-tag = "0.0.0"