crepes>=0.8.0
joblib>=1.3.0
loguru>=0.7.3
matplotlib>=3.10.1
numpy>=1.26.4
pandas>=2.2.3
rdkit>=2023.9.1
scikit-learn>=1.8.0
scipy>=1.15.2
shap>=0.47.1
typing-extensions>=4.13.1

[chemprop]
chemprop<2.3.0,>=2.2.0
dvc>=3.64.1
lightning>=2.5.1
requests>=2.32.5

[notebooks]
jupyterlab>=4.4.0
seaborn>=0.13.2
