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Merge branch 'documentation_improvements' into refactor_black
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RiesBen committed Aug 21, 2024
2 parents 64fd89d + 9c00002 commit fc7f20e
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336 changes: 167 additions & 169 deletions examples/konnektor_example.ipynb

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531 changes: 347 additions & 184 deletions examples/konnektor_networks.ipynb

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24 changes: 12 additions & 12 deletions pyproject.toml
Original file line number Diff line number Diff line change
Expand Up @@ -16,33 +16,33 @@ authors=[
{name="Mike Henry", email="[email protected]"},
{name="Richard J Gowers", email="[email protected]"},
]
description="Konnektor is a package for calculating networks."
readme="README.md"
requires-python = ">=3.9"
classifiers = [
"Programming Language :: Python :: 3",
"License :: OSI Approved :: MIT License",
"Operating System :: OS Independent",
]

dependencies = [
'gufe',
'numpy',
'rdkit',
'networkx',
'scikit-mol',
'scikit-learn',
'ipycytoscape'
'ipycytoscape',
]

[project.optional-dependencies]
test = [
'pytest',
'pytest-cov[all]'
'pytest-cov[all]',
]
dev = [
'black',
'pre-commit'
]

description="Konnektor is a package for calculating networks."
readme="README.md"
requires-python = ">=3.9"
classifiers = [
"Programming Language :: Python :: 3",
"License :: OSI Approved :: MIT License",
"Operating System :: OS Independent",
'pre-commit',
]

[project.urls]
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