PyPI page
Author:
Huanni Zhang
License:
MIT License
Copyright (c) 2025, Huanni Zhang
Permission is hereby granted, free of charge, to any person obtaining a copy of this software and associated
docu...
Summary:
A Chemistry-Focused Predictor of Toxicity Risks in Late-Stage Drug Development
Latest version:
0.2.0
Required dependencies:
acm-hamburg-legacy
|
chembl-structure-pipeline
|
cirpy
|
click
|
fpsim2
|
joblib
|
matplotlib
|
numpy
|
pandas
|
psutil
|
pyzmq
|
rdkit
|
requests
|
scikit-learn
|
seaborn
Optional dependencies:
build
|
bump-my-version
|
coverage
|
myst-parser
|
pytest
|
pytest-cov
|
ruff
|
sphinx
|
sphinx-autoapi
|
sphinx-rtd-theme
|
tox
|
twine
|
wheel
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