Drug Discovery On Toxcast

AUC

평가 결과

이 벤치마크에서 각 모델의 성능 결과

모델 이름	AUC	Paper Title	Repository
TrimNet	0.777	TrimNet: learning molecular representation from triplet messages for biomedicine
GraphConv	0.754	Convolutional Networks on Graphs for Learning Molecular Fingerprints
GraphConv + dummy super node	0.768	Learning Graph-Level Representation for Drug Discovery
GIT-Mol(G+S)	0.668	GIT-Mol: A Multi-modal Large Language Model for Molecular Science with Graph, Image, and Text
ContextPred	0.657	Strategies for Pre-training Graph Neural Networks	-

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