PyPI page
Author:
Tieu Long Phan
Summary:
Utility for reaction modeling using graph grammar
Latest version:
1.6.3
Required dependencies:
joblib
|
matplotlib
|
networkx
|
numpy
|
pandas
|
pillow
|
rdkit
|
regex
|
requests
|
scikit-learn
|
scipy
|
seaborn
|
tqdm
Optional dependencies:
flake8
|
graphviz
|
myst-parser
|
psutil
|
pulp
|
pydata-sphinx-theme
|
pytest
|
sphinx
|
sphinx-copybutton
|
sphinx-design
|
sphinx-rtd-theme
|
sphinx-togglebutton
|
sphinxcontrib-bibtex
|
sympy
|
torch
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