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Phoenics: A Bayesian Optimizer for Chemistry
[Image: see text] We report Phoenics, a probabilistic global optimization algorithm identifying the set of conditions of an experimental or computational procedure which satisfies desired targets. Phoenics combines ideas from Bayesian optimization with concepts from Bayesian kernel density estimatio...
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| Publicado no: | ACS Cent Sci |
|---|---|
| Main Authors: | , , , |
| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
American Chemical
Society
2018
|
| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC6161047/ https://ncbi.nlm.nih.gov/pubmed/30276246 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acscentsci.8b00307 |
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