Digital Discovery
 2024
DOI: 10.1039/d4dd00225c
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Cost-informed Bayesian reaction optimization

Alexandre A. Schoepfer,
Jan Weinreich,
Ruben Laplaza
et al.

Abstract: Bayesian optimization (BO) is an efficient method for solving complex optimization problems, including those in chemical research, where consequently it is gaining significant popularity. Although effective in guiding experimental design,...

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