PyPI page
Author:
Hadrien Mary
Summary:
A python library to work with molecules. Built on top of RDKit.
Latest version:
0.13.0
Required dependencies:
fsspec
|
gcsfs
|
joblib
|
loguru
|
matplotlib
|
networkx
|
nglview
|
numpy
|
openpyxl
|
packaging
|
pandas
|
pillow
|
platformdirs
|
pyarrow
|
rdkit
|
s3fs
|
scikit-learn
|
scipy
|
selfies
|
tqdm
|
xlsxwriter
Optional dependencies:
black
|
build
|
ipykernel
|
ipywidgets
|
markdown-include
|
mdx-truly-sane-lists
|
mike
|
mkdocs
|
mkdocs-jupyter
|
mkdocs-material
|
mkdocs-material-extensions
|
mkdocstrings
|
mypy
|
nbconvert
|
nbformat
|
pre-commit
|
pyright
|
pytest
|
pytest-cov
|
pytest-xdist
|
ruff
|
seaborn
|
twine
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