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Reaction Classification on Enzyme Reaction

89.5Reaction AccuracyCDConv w/ MRM
7.8629.05550.2571.445Jun 21, 2026

Evaluation results

MethodLinks
CDConv w/ MRMInput Dimensionality=(3+1)D, MRM=true2026.0689.5—
CDConvInput Dimensionality=(3+1)D2026.0688.5—
GearNet-Edge w/ MRMInput Dimensionality=(3+1)D, MRM=true2026.0687.5—
IEConvInput Dimensionality=(3+1)D2026.0687.2—
New IEConvInput Dimensionality=(3+1)D2026.0687.2—
ProNet w/ MRMInput Dimensionality=(3+1)D, MRM=true2026.0687.2—
GearNet-EdgeInput Dimensionality=(3+1)D2026.0686.6—
ProNetInput Dimensionality=(3+1)D2026.0686—
GearNet w/ MRMInput Dimensionality=(3+1)D, MRM=true2026.0681.1—
GearNetInput Dimensionality=(3+1)D2026.0679.4—
3DCNNInput Dimensionality=3D2026.0672.2—
GCNInput Dimensionality=3D2026.0667.3—
GVPInput Dimensionality=(3+1)D2026.0665.5—
GraphQAInput Dimensionality=(3+1)D2026.0660.8—
GATInput Dimensionality=3D2026.0655.6—
CNNInput Dimensionality=1D2026.0651.7—
TransformerInput Dimensionality=1D2026.0626.6—
ResNetInput Dimensionality=1D2026.0624.1—
LSTMInput Dimensionality=1D2026.0611—
CDConv w/ MRMPretraining Dataset=-2026.06—89.5
DeepFRIPretraining Dataset=Pfam 10M2026.06—63.3
ESM-1bPretraining Dataset=UniRef50 24M2026.06—83.1
ESM-2Pretraining Dataset=UniRef50 24M2026.06—87.2
GearNet-E-IE with APPretraining Dataset=AlphaFoldDB 805K2026.06—86.8
GearNet-E-IE with DPPretraining Dataset=AlphaFoldDB 805K2026.06—87.5
GearNet-E-IE with DPPretraining Dataset=AlphaFoldDB 805K2026.06—87
GearNet-E-IE with MCPretraining Dataset=AlphaFoldDB 805K2026.06—87.5
GearNet-E-IE with RTPPretraining Dataset=AlphaFoldDB 805K2026.06—86.6
IEConv (Residue Level)Pretraining Dataset=PDB 476K2026.06—88.1
ProtBERT-BFDPretraining Dataset=BFD 2.1B2026.06—72.2
SaProt-PDBPretraining Dataset=PDB 60K2026.06—87.7