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Parallel multi-droplet platform for reaction kinetics and optimization

We present an automated droplet reactor platform possessing parallel reactor channels and a scheduling algorithm that orchestrates all of the parallel hardware operations and ensures droplet integrity as well as overall efficiency. We design and incorporate all of the necessary hardware and software...

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Detalles Bibliográficos
Autores principales: Eyke, Natalie S., Schneider, Timo N., Jin, Brooke, Hart, Travis, Monfette, Sebastien, Hawkins, Joel M., Morse, Peter D., Howard, Roger M., Pfisterer, David M., Nandiwale, Kakasaheb Y., Jensen, Klavs F.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: The Royal Society of Chemistry 2023
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10445457/
https://www.ncbi.nlm.nih.gov/pubmed/37621435
http://dx.doi.org/10.1039/d3sc02082g
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author Eyke, Natalie S.
Schneider, Timo N.
Jin, Brooke
Hart, Travis
Monfette, Sebastien
Hawkins, Joel M.
Morse, Peter D.
Howard, Roger M.
Pfisterer, David M.
Nandiwale, Kakasaheb Y.
Jensen, Klavs F.
author_facet Eyke, Natalie S.
Schneider, Timo N.
Jin, Brooke
Hart, Travis
Monfette, Sebastien
Hawkins, Joel M.
Morse, Peter D.
Howard, Roger M.
Pfisterer, David M.
Nandiwale, Kakasaheb Y.
Jensen, Klavs F.
author_sort Eyke, Natalie S.
collection PubMed
description We present an automated droplet reactor platform possessing parallel reactor channels and a scheduling algorithm that orchestrates all of the parallel hardware operations and ensures droplet integrity as well as overall efficiency. We design and incorporate all of the necessary hardware and software to enable the platform to be used to study both thermal and photochemical reactions. We incorporate a Bayesian optimization algorithm into the control software to enable reaction optimization over both categorical and continuous variables. We demonstrate the capabilities of both the preliminary single-channel and parallelized versions of the platform using a series of model thermal and photochemical reactions. We conduct a series of reaction optimization campaigns and demonstrate rapid acquisition of the data necessary to determine reaction kinetics. The platform is flexible in terms of use case: it can be used either to investigate reaction kinetics or to perform reaction optimization over a wide range of chemical domains.
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spelling pubmed-104454572023-08-24 Parallel multi-droplet platform for reaction kinetics and optimization Eyke, Natalie S. Schneider, Timo N. Jin, Brooke Hart, Travis Monfette, Sebastien Hawkins, Joel M. Morse, Peter D. Howard, Roger M. Pfisterer, David M. Nandiwale, Kakasaheb Y. Jensen, Klavs F. Chem Sci Chemistry We present an automated droplet reactor platform possessing parallel reactor channels and a scheduling algorithm that orchestrates all of the parallel hardware operations and ensures droplet integrity as well as overall efficiency. We design and incorporate all of the necessary hardware and software to enable the platform to be used to study both thermal and photochemical reactions. We incorporate a Bayesian optimization algorithm into the control software to enable reaction optimization over both categorical and continuous variables. We demonstrate the capabilities of both the preliminary single-channel and parallelized versions of the platform using a series of model thermal and photochemical reactions. We conduct a series of reaction optimization campaigns and demonstrate rapid acquisition of the data necessary to determine reaction kinetics. The platform is flexible in terms of use case: it can be used either to investigate reaction kinetics or to perform reaction optimization over a wide range of chemical domains. The Royal Society of Chemistry 2023-08-04 /pmc/articles/PMC10445457/ /pubmed/37621435 http://dx.doi.org/10.1039/d3sc02082g Text en This journal is © The Royal Society of Chemistry https://creativecommons.org/licenses/by/3.0/
spellingShingle Chemistry
Eyke, Natalie S.
Schneider, Timo N.
Jin, Brooke
Hart, Travis
Monfette, Sebastien
Hawkins, Joel M.
Morse, Peter D.
Howard, Roger M.
Pfisterer, David M.
Nandiwale, Kakasaheb Y.
Jensen, Klavs F.
Parallel multi-droplet platform for reaction kinetics and optimization
title Parallel multi-droplet platform for reaction kinetics and optimization
title_full Parallel multi-droplet platform for reaction kinetics and optimization
title_fullStr Parallel multi-droplet platform for reaction kinetics and optimization
title_full_unstemmed Parallel multi-droplet platform for reaction kinetics and optimization
title_short Parallel multi-droplet platform for reaction kinetics and optimization
title_sort parallel multi-droplet platform for reaction kinetics and optimization
topic Chemistry
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10445457/
https://www.ncbi.nlm.nih.gov/pubmed/37621435
http://dx.doi.org/10.1039/d3sc02082g
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