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SotA/Medical/Drug Discovery/tdcommons

Drug Discovery on tdcommons

Metric: TDC.Clearance_Hepatocyte_AZ (higher is better)

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#Model↕TDC.Clearance_Hepatocyte_AZ▼Extra DataPaperDate↕Code
1XGBoost0.587NoAccurate ADMET Prediction with XGBoost2022-04-15Code
2AttrMasking0.413NoTherapeutics Data Commons: Machine Learning Data...2021-02-18Code
3MLP-RDKit2D0.382NoTherapeutics Data Commons: Machine Learning Data...2021-02-18Code
4GCN0.366NoTherapeutics Data Commons: Machine Learning Data...2021-02-18Code
5AttentiveFP0.289NoTherapeutics Data Commons: Machine Learning Data...2021-02-18Code