A single decoder-only model generates prompt-conditioned retrosynthetic routes and shows measurable gains on depth and required-leaf constraints in the RetroCast/PaRoutes benchmarks while releasing its code.
Coley, Yiming Mo, Regina Barzilay, and Klavs F
2 Pith papers cite this work. Polarity classification is still indexing.
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2026 2verdicts
UNVERDICTED 2representative citing papers
MORetro* applies multi-objective A* search with weighted scalarization and BO-informed sampling to produce Pareto fronts of retrosynthetic routes with optimality guarantees when the single-step model is admissible.
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