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Enzyme-to-Reaction Retrieval on ReactZyme (Enzyme Similarity-based Split)

93.1Hit@1TIGER
5.7428.4251.173.78May 23, 2026

Evaluation results

MethodLinks
TIGERText source=ESM2Text2026.0593.195.6
TIGERText source=ProtT32026.0590.894
Bi-RNNEncoder=MAT-2D + ESM2026.0581.588.6
Bi-RNNEncoder=UniMol-3D + ESM2026.0581.187.5
CLIPZymeEncoder=UniMol-3D + ESM2026.0575.585.5
ReactZymeEncoder=UniMol-3D + ESM2026.0572.781.1
GNNEncoder=UniMol-3D + ESM2026.0571.180.2
GNNEncoder=UniMol-3D + SaProt2026.0563.374.6
ReactZymeEncoder=UniMol-3D + SaProt2026.056072.3
ReactZymeEncoder=MAT-2D + ESM2026.0559.972.8
Fingerprint2026.0557.963.9
CLIPZymeEncoder=MAT-2D + ESM2026.0554.969.7
TIGERText source=ESM2Text2026.0541.651.8
TIGERText source=ProtT32026.0538.647.2
CLIPZymeEncoder=UniMol-3D + ESM2026.0513.119.4
CLIPZymeEncoder=MAT-2D + ESM2026.0512.422
Bi-RNNEncoder=MAT-2D + ESM2026.0511.824
GNNEncoder=UniMol-3D + ESM2026.051120.1
ReactZymeEncoder=MAT-2D + ESM2026.0510.919.9
Bi-RNNEncoder=UniMol-3D + ESM2026.0510.919.7
GNNEncoder=UniMol-3D + SaProt2026.059.619.7
ReactZymeEncoder=UniMol-3D + SaProt2026.059.419.4
Fingerprint2026.059.419.4
ReactZymeEncoder=UniMol-3D + ESM2026.059.120.1