Drug Discovery On Bbbp
評価指標
AUC
評価結果
このベンチマークにおける各モデルのパフォーマンス結果
モデル名 | AUC | Paper Title | Repository |
|---|---|---|---|
| ProtoW-L2 | 0.92 | Optimal Transport Graph Neural Networks | |
| GIT-Mol(G+S) | 0.739 | GIT-Mol: A Multi-modal Large Language Model for Molecular Science with Graph, Image, and Text | |
| ContextPred | 0.687 | Strategies for Pre-training Graph Neural Networks | - |
| elEmBERT-V1 | 0.905 | Structure to Property: Chemical Element Embeddings and a Deep Learning Approach for Accurate Prediction of Chemical Properties |
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