rdkit==2025.03.1
seaborn==0.13.2
pandas==2.2.2
joblib==1.4.2
scikit-learn==1.5.1
xgboost==2.1.1
catboost==1.2.7
optuna==4.0.0
numpy==1.26.4
matplotlib==3.9.2
scikit-posthocs==0.11.2
pingouin==0.5.5
scipy==1.14.1
statsmodels==0.14.4
mapie==0.9.2
mordred==1.2.0