"ChemBO: Bayesian Optimization of Small Organic Molecules with ..."

Ksenia Korovina et al. (2020)

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DOI: —

access: open

type: Conference or Workshop Paper

metadata version: 2020-11-17

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Ksenia Korovina, Sailun Xu, Kirthevasan Kandasamy, Willie Neiswanger, Barnabás Póczos, Jeff Schneider, Eric P. Xing:
ChemBO: Bayesian Optimization of Small Organic Molecules with Synthesizable Recommendations. AISTATS 2020: 3393-3403

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