gradio==3.32.0
mordred==1.2.0
numpy==1.21.6
pandas==1.3.5
rdkit_pypi==2022.3.2.1
torch==1.13.0
https://data.pyg.org/whl/torch-1.13.0%2Bcu116/torch_scatter-2.1.1%2Bpt113cu116-cp310-cp310-linux_x86_64.whl
https://data.pyg.org/whl/torch-1.13.0%2Bcu116/torch_sparse-0.6.17%2Bpt113cu116-cp310-cp310-linux_x86_64.whl

torch_geometric==2.0.4