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Robotic Modules for the Programmable Chemputation of Molecules and Materials

[Image: see text] Before leveraging big data methods like machine learning and artificial intelligence (AI) in chemistry, there is an imperative need for an affordable, universal digitization standard. This mirrors the foundational requisites of the digital revolution, which demanded standard archit...

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Autores principales: Salley, Daniel, Manzano, J. Sebastián, Kitson, Philip J., Cronin, Leroy
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2023
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10450877/
https://www.ncbi.nlm.nih.gov/pubmed/37637738
http://dx.doi.org/10.1021/acscentsci.3c00304
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author Salley, Daniel
Manzano, J. Sebastián
Kitson, Philip J.
Cronin, Leroy
author_facet Salley, Daniel
Manzano, J. Sebastián
Kitson, Philip J.
Cronin, Leroy
author_sort Salley, Daniel
collection PubMed
description [Image: see text] Before leveraging big data methods like machine learning and artificial intelligence (AI) in chemistry, there is an imperative need for an affordable, universal digitization standard. This mirrors the foundational requisites of the digital revolution, which demanded standard architectures with precise specifications. Recently, we have developed automated platforms tailored for chemical AI-driven exploration, including the synthesis of molecules, materials, nanomaterials, and formulations. Our focus has been on designing and constructing affordable standard hardware and software modules that serve as a blueprint for chemistry digitization across varied fields. Our platforms can be categorized into four types based on their applications: (i) discovery systems for the exploration of chemical space and novel reactivity, (ii) systems for the synthesis and manufacture of fine chemicals, (iii) platforms for formulation discovery and exploration, and (iv) systems for materials discovery and synthesis. We also highlight the convergent evolution of these platforms through shared hardware, firmware, and software alongside the creation of a unique programming language for chemical and material systems. This programming approach is essential for reliable synthesis, designing experiments, discovery, optimization, and establishing new collaboration standards. Furthermore, it is crucial for verifying literature findings, enhancing experimental outcome reliability, and fostering collaboration and sharing of unsuccessful experiments across different research labs.
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spelling pubmed-104508772023-08-26 Robotic Modules for the Programmable Chemputation of Molecules and Materials Salley, Daniel Manzano, J. Sebastián Kitson, Philip J. Cronin, Leroy ACS Cent Sci [Image: see text] Before leveraging big data methods like machine learning and artificial intelligence (AI) in chemistry, there is an imperative need for an affordable, universal digitization standard. This mirrors the foundational requisites of the digital revolution, which demanded standard architectures with precise specifications. Recently, we have developed automated platforms tailored for chemical AI-driven exploration, including the synthesis of molecules, materials, nanomaterials, and formulations. Our focus has been on designing and constructing affordable standard hardware and software modules that serve as a blueprint for chemistry digitization across varied fields. Our platforms can be categorized into four types based on their applications: (i) discovery systems for the exploration of chemical space and novel reactivity, (ii) systems for the synthesis and manufacture of fine chemicals, (iii) platforms for formulation discovery and exploration, and (iv) systems for materials discovery and synthesis. We also highlight the convergent evolution of these platforms through shared hardware, firmware, and software alongside the creation of a unique programming language for chemical and material systems. This programming approach is essential for reliable synthesis, designing experiments, discovery, optimization, and establishing new collaboration standards. Furthermore, it is crucial for verifying literature findings, enhancing experimental outcome reliability, and fostering collaboration and sharing of unsuccessful experiments across different research labs. American Chemical Society 2023-07-26 /pmc/articles/PMC10450877/ /pubmed/37637738 http://dx.doi.org/10.1021/acscentsci.3c00304 Text en © 2023 The Authors. Published by American Chemical Society https://creativecommons.org/licenses/by/4.0/Permits the broadest form of re-use including for commercial purposes, provided that author attribution and integrity are maintained (https://creativecommons.org/licenses/by/4.0/).
spellingShingle Salley, Daniel
Manzano, J. Sebastián
Kitson, Philip J.
Cronin, Leroy
Robotic Modules for the Programmable Chemputation of Molecules and Materials
title Robotic Modules for the Programmable Chemputation of Molecules and Materials
title_full Robotic Modules for the Programmable Chemputation of Molecules and Materials
title_fullStr Robotic Modules for the Programmable Chemputation of Molecules and Materials
title_full_unstemmed Robotic Modules for the Programmable Chemputation of Molecules and Materials
title_short Robotic Modules for the Programmable Chemputation of Molecules and Materials
title_sort robotic modules for the programmable chemputation of molecules and materials
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10450877/
https://www.ncbi.nlm.nih.gov/pubmed/37637738
http://dx.doi.org/10.1021/acscentsci.3c00304
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