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pyproject.toml
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pyproject.toml
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[build-system]
requires = [
"hatchling",
"jupyterlab==3.*",
]
build-backend = "hatchling.build"
[project]
name = "mols2grid"
description = "Interactive 2D small molecule viewer"
readme = "README.md"
requires-python = ">=3.7"
authors = [
{ name = "Cédric Bouysset", email = "cedric@bouysset.net" },
]
keywords = [
"cheminformatics",
"chemistry",
"jupyter",
"science",
"widgets",
]
classifiers = [
"Development Status :: 5 - Production/Stable",
"Framework :: Jupyter",
"Intended Audience :: Science/Research",
"License :: OSI Approved :: Apache Software License",
"Operating System :: OS Independent",
"Programming Language :: Python :: 3",
"Programming Language :: Python :: 3.7",
"Programming Language :: Python :: 3.8",
"Programming Language :: Python :: 3.9",
"Programming Language :: Python :: 3.10",
"Topic :: Scientific/Engineering :: Chemistry",
]
dependencies = [
"ipywidgets>=7,<8",
"jinja2>=2.11.0",
"numpy",
"pandas",
]
dynamic = ["version"]
[project.license]
file = "LICENSE"
[project.optional-dependencies]
build = [
"build",
]
tests = [
"cairosvg==2.5.2",
"flaky==3.7.0",
"pyautogecko==0.1.3",
"imagehash~=4.3",
"ipython==7.12.0",
"pytest-cov==2.12.1",
"pytest==6.2.5",
"selenium==4.10.0",
]
docs = [
"mistune<3.0.0",
]
dev = [
"mols2grid[build,tests,docs]",
]
[project.urls]
Homepage = "https://github.com/cbouy/mols2grid"
Documentation = "https://mols2grid.readthedocs.io/en/latest/"
Discussions = "https://github.com/cbouy/mols2grid/discussions"
Issues = "https://github.com/cbouy/mols2grid/issues"
Changelog = "https://github.com/cbouy/mols2grid/blob/master/CHANGELOG.md"
[tool.setuptools.dynamic]
version = { attr = "mols2grid._version.__version__" }
[tool.hatch.version]
path = "mols2grid/_version.py"
[tool.hatch.build]
artifacts = [
"mols2grid/nbextension/index.*",
"mols2grid/labextension",
]
[tool.hatch.build.targets.wheel.shared-data]
"mols2grid/nbextension" = "share/jupyter/nbextensions/mols2grid"
"mols2grid/labextension" = "share/jupyter/labextensions/mols2grid"
"./install.json" = "share/jupyter/labextensions/mols2grid/install.json"
"./mols2grid.json" = "etc/jupyter/nbconfig/notebook.d/mols2grid.json"
[tool.hatch.build.targets.sdist]
exclude = [
".github",
]
[tool.hatch.build.hooks.jupyter-builder]
ensured-targets = [
"mols2grid/nbextension/index.js",
"mols2grid/labextension/package.json",
]
skip-if-exists = [
"mols2grid/nbextension/index.js",
"mols2grid/labextension/package.json",
]
dependencies = [
"hatch-jupyter-builder>=0.8.1",
]
build-function = "hatch_jupyter_builder.npm_builder"
[tool.hatch.build.hooks.jupyter-builder.build-kwargs]
path = "."
build_cmd = "build:prod"
[tool.black]
line-length = 88
extend-exclude = '''
(
^/docs/conf.py
)
'''
[tool.isort]
profile = "black"