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RetroReasoner: A Reasoning LLM for Strategic Retrosynthesis Prediction

Ko, Hanbum et al.
arXiv (All) · Papers
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machine-learning
Retrosynthesis prediction aims to identify reactants that can synthesize a given product molecule. Although molecular large language models (LLMs) have recently shown promising results, most existing methods either generate reactants directly or provide only generic product-level analysis, without e
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