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Sequential closed-loop Bayesian optimization as a guide for organic molecular metallophotocatalyst formulation discovery.

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Title: Sequential closed-loop Bayesian optimization as a guide for organic molecular metallophotocatalyst formulation discovery.
Authors: Li X; Key Laboratory of the Ministry of Education for Advanced Catalysis Materials, Zhejiang Key Laboratory for Reactive Chemistry on Solid Surfaces, Zhejiang Normal University, Jinhua, China. xiaobo.li@zjnu.edu.cn.; Materials Innovation Factory and Department of Chemistry, University of Liverpool, Liverpool, UK. xiaobo.li@zjnu.edu.cn., Che Y; Materials Innovation Factory and Department of Chemistry, University of Liverpool, Liverpool, UK.; Leverhulme Research Centre for Functional Materials Design, University of Liverpool, Liverpool, UK., Chen L; School of Chemistry and School of Computer Science, University of Birmingham, Birmingham, UK. l.j.chen@bham.ac.uk., Liu T; Materials Innovation Factory and Department of Chemistry, University of Liverpool, Liverpool, UK., Wang K; Department of Chemistry and Chemical Engineering, Shanxi Datong University, Datong, China., Liu L; Materials Innovation Factory and Department of Chemistry, University of Liverpool, Liverpool, UK., Yang H; Materials Innovation Factory and Department of Chemistry, University of Liverpool, Liverpool, UK.; Leverhulme Research Centre for Functional Materials Design, University of Liverpool, Liverpool, UK., Pyzer-Knapp EO; IBM Research, Daresbury, UK. epyzerk3@uk.ibm.com., Cooper AI; Materials Innovation Factory and Department of Chemistry, University of Liverpool, Liverpool, UK. aicooper@liverpool.ac.uk.; Leverhulme Research Centre for Functional Materials Design, University of Liverpool, Liverpool, UK. aicooper@liverpool.ac.uk.
Source: Nature chemistry [Nat Chem] 2024 Aug; Vol. 16 (8), pp. 1286-1294. Date of Electronic Publication: 2024 Jun 11.
Publication Type: Journal Article
Journal Info: Publisher: Nature Pub. Group Country of Publication: England NLM ID: 101499734 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1755-4349 (Electronic) Linking ISSN: 17554330 NLM ISO Abbreviation: Nat Chem Subsets: MEDLINE; PubMed not MEDLINE
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  Data: Sequential closed-loop Bayesian optimization as a guide for organic molecular metallophotocatalyst formulation discovery.
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  Data: <searchLink fieldCode="AU" term="%22Li+X%22">Li X</searchLink>; Key Laboratory of the Ministry of Education for Advanced Catalysis Materials, Zhejiang Key Laboratory for Reactive Chemistry on Solid Surfaces, Zhejiang Normal University, Jinhua, China. xiaobo.li@zjnu.edu.cn.; Materials Innovation Factory and Department of Chemistry, University of Liverpool, Liverpool, UK. xiaobo.li@zjnu.edu.cn.<br /><searchLink fieldCode="AU" term="%22Che+Y%22">Che Y</searchLink>; Materials Innovation Factory and Department of Chemistry, University of Liverpool, Liverpool, UK.; Leverhulme Research Centre for Functional Materials Design, University of Liverpool, Liverpool, UK.<br /><searchLink fieldCode="AU" term="%22Chen+L%22">Chen L</searchLink>; School of Chemistry and School of Computer Science, University of Birmingham, Birmingham, UK. l.j.chen@bham.ac.uk.<br /><searchLink fieldCode="AU" term="%22Liu+T%22">Liu T</searchLink>; Materials Innovation Factory and Department of Chemistry, University of Liverpool, Liverpool, UK.<br /><searchLink fieldCode="AU" term="%22Wang+K%22">Wang K</searchLink>; Department of Chemistry and Chemical Engineering, Shanxi Datong University, Datong, China.<br /><searchLink fieldCode="AU" term="%22Liu+L%22">Liu L</searchLink>; Materials Innovation Factory and Department of Chemistry, University of Liverpool, Liverpool, UK.<br /><searchLink fieldCode="AU" term="%22Yang+H%22">Yang H</searchLink>; Materials Innovation Factory and Department of Chemistry, University of Liverpool, Liverpool, UK.; Leverhulme Research Centre for Functional Materials Design, University of Liverpool, Liverpool, UK.<br /><searchLink fieldCode="AU" term="%22Pyzer-Knapp+EO%22">Pyzer-Knapp EO</searchLink>; IBM Research, Daresbury, UK. epyzerk3@uk.ibm.com.<br /><searchLink fieldCode="AU" term="%22Cooper+AI%22">Cooper AI</searchLink>; Materials Innovation Factory and Department of Chemistry, University of Liverpool, Liverpool, UK. aicooper@liverpool.ac.uk.; Leverhulme Research Centre for Functional Materials Design, University of Liverpool, Liverpool, UK. aicooper@liverpool.ac.uk.
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  Data: <searchLink fieldCode="JN" term="%22101499734%22">Nature chemistry</searchLink> [Nat Chem] 2024 Aug; Vol. 16 (8), pp. 1286-1294. <i>Date of Electronic Publication: </i>2024 Jun 11.
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