Cython==3.0.10
chembl-webresource-client==0.10.9
cryptography==42.0.5
datamol==0.12.4
dgl==2.1.0
dgllife==0.3.2
huggingface-hub==0.22.2
joblib==1.3.2
keras==3.0.5
matplotlib==3.8.3
medchem==2.0.4
mlflow==2.11.1
molfeat==0.10.0
numpy==1.26.4
pandas==2.2.1
pubchempy==1.0.4
pytdc==0.3.6
rdkit==2023.9.5
scikit-learn==1.4.1.post1
scikit-optimize==0.10.1
scipy==1.12.0
seaborn==0.13.2
tensorflow==2.16.1
torch==2.2.1
transformers==4.39.3
urllib3==2.0.7
xgboost==2.0.3
splito==0.1.2
