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synthesizable molecule

2 papers

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Co-occurring keywords · papers mentioning both

syntax-guided synthesis (1) molecular design (1) evolutionary algorithm (1) bayesian optimization (1) gaussian process (1) markov decision process (1) markov chain monte carlo (1) program synthesis (1) optimal transport (1)

Papers

Procedural Synthesis of Synthesizable Molecules ICLR 2025 ChemBO: Bayesian Optimization of Small Organic Molecules with Synthesizable Recommendations AISTATS 2020