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Elementary step prediction on FlowER 19 (original)

99.7Top-1 AccuracyT5
97.422498.013798.60599.1963Dec 5, 2025

Evaluation results

MethodLinks
T5Backbone=T5, Tokenizer=MechSMILES2025.1299.799.89
LLaMaBackbone=LLaMa, Tokenizer=MechSMILES2025.1297.5198.65