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Retrosynthesis Prediction on Rare Template Evaluation (hard instances)

14Exact Match (Top-1)RetroReasoner
11.9212.461313.54Mar 13, 2026

Evaluation results

MethodLinks
RetroReasonerOptimization Strategy=SFT2026.031463419258.75.2
RetroReasonerOptimization Strategy=RL2026.031370399562.54.25
Prediction-OnlyOptimization Strategy=SFT2026.0312652492563.2
Prediction-OnlyOptimization Strategy=RL2026.031264228962.12.66