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| streamlit | |
| streamlit_ketcher | |
| CGRtools==4.1.35 | |
| py-mini-racer | |
| pandas>=1.4 | |
| toytree>=2.0 | |
| ray>=2.0 | |
| click>=8.0.0 | |
| StructureFingerprint==2.1 | |
| werkzeug | |
| gdown==4.6.3 | |
| ordered-set==4.1.0 | |
| numpy>=1.26 | |
| chytorch==1.60 | |
| chytorch-rxnmap==1.4 | |
| adabelief-pytorch | |
| scikit-learn==1.4.1.post1 | |
| scipy==1.12.0 | |
| pandas==2.2.1 | |
| altair | |
| pytorch-lightning | |
| torch-cluster | |
| torch-scatter | |
| torch-sparse | |
| torch-spline-conv | |
| torch_geometric | |
| torchmetrics | |
| torchtyping | |
| git+https://github.com/pyg-team/[email protected] | |