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[build-system]
requires = ["setuptools", "scikit-build-core"]
build-backend = "scikit_build_core.build"
[tool.scikit-build]
cmake.source-dir = "skbuild"
[project]
name = "IsoSpecPy"
dependencies = ["cffi"]
description = "IsoSpecPy is a Python library for computing isotopic distributions of molecules."
version = "2.3.2"
license = "BSD-2-Clause"
license-files = ["LICENCE"]
authors = [{name = "Michał Startek"}, {name = "Mateusz Łącki"}]
readme = "README.md"
requires-python = ">=3.6"
classifiers = [
"Programming Language :: Python :: 3",
"Programming Language :: Python :: 3.6",
"Topic :: Software Development :: Libraries :: Python Modules",
"Development Status :: 5 - Production/Stable",
"Operating System :: OS Independent",
]
keywords = ["isotopic distribution", "mass spectrometry", "chemistry", "isotopic envelope", "isotopologues"]
[project.urls]
Homepage = "https://github.com/MatteoLacki/IsoSpec"
Repository = "https://github.com/MatteoLacki/IsoSpec"
[project.optional-dependencies]
testing = ["pytest", "OldIsoSpecPy"]
[tool.pytest.ini_options]
testpaths = ["tests/Python"]
[tool.cibuildwheel]
enable = ["pypy"]
skip = ["cp36-*", "cp37-*", "pp37-*"]
test-command = "python -m pytest {project}/tests/Python"
#test-sources = ["tests/Python"]
test-extras = ["testing"]
[tool.scikit-build.sdist]
exclude = ["**/*"]
include = [
"/src/IsoSpecPy/*.py",
"/src/IsoSpec++/*.c",
"/src/IsoSpec++/*.h",
"/src/IsoSpec++/*.hpp",
"/src/IsoSpec++/*.cpp",
"/LICENCE",
"/README.md",
"/pyproject.toml",
"/skbuild/CMakeLists.txt"
]
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