Drug Discovery On Clintox

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

		Paper Title
BiLSTM	0.97	Accelerating Drug Safety Assessment using Bidirectional-LSTM for SMILES Data
TrimNet	0.948	TrimNet: learning molecular representation from triplet messages for biomedicine
GIT-Mol(G+S)	0.883	GIT-Mol: A Multi-modal Large Language Model for Molecular Science with Graph, Image, and Text
ContextPred	0.726	Strategies for Pre-training Graph Neural Networks

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