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Working at the interfaces of data science and synthetic electrochemistry
Electrochemistry is quickly entering the mainstream of synthetic organic chemistry. The diversity of new transformations enabled by electrochemistry is to a large extent a consequence of the unique features and reaction parameters in electrochemical systems including redox mediators, applied potenti...
Autores principales: | , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
2022
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9014485/ https://www.ncbi.nlm.nih.gov/pubmed/35441154 http://dx.doi.org/10.1016/j.tchem.2022.100012 |
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author | Alvarado, Jesus I. Martinez Meinhardt, Jonathan M. Lin, Song |
author_facet | Alvarado, Jesus I. Martinez Meinhardt, Jonathan M. Lin, Song |
author_sort | Alvarado, Jesus I. Martinez |
collection | PubMed |
description | Electrochemistry is quickly entering the mainstream of synthetic organic chemistry. The diversity of new transformations enabled by electrochemistry is to a large extent a consequence of the unique features and reaction parameters in electrochemical systems including redox mediators, applied potential, electrode material, and cell construction. While offering chemists new means to control reactivity and selectivity, these additional features also increase the dimensionalities of a reaction system and complicate its optimization. This challenge, however, has spawned increasing adoption of data science tools to aid reaction discovery as well as development of high-throughput screening platforms that facilitate the generation of high quality datasets. In this Perspective, we provide an overview of recent advances in data-science driven electrochemistry with an emphasis on the opportunities and challenges facing this growing subdiscipline. |
format | Online Article Text |
id | pubmed-9014485 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2022 |
record_format | MEDLINE/PubMed |
spelling | pubmed-90144852022-04-18 Working at the interfaces of data science and synthetic electrochemistry Alvarado, Jesus I. Martinez Meinhardt, Jonathan M. Lin, Song Tetrahedron Chem Article Electrochemistry is quickly entering the mainstream of synthetic organic chemistry. The diversity of new transformations enabled by electrochemistry is to a large extent a consequence of the unique features and reaction parameters in electrochemical systems including redox mediators, applied potential, electrode material, and cell construction. While offering chemists new means to control reactivity and selectivity, these additional features also increase the dimensionalities of a reaction system and complicate its optimization. This challenge, however, has spawned increasing adoption of data science tools to aid reaction discovery as well as development of high-throughput screening platforms that facilitate the generation of high quality datasets. In this Perspective, we provide an overview of recent advances in data-science driven electrochemistry with an emphasis on the opportunities and challenges facing this growing subdiscipline. 2022-03 2022-03-26 /pmc/articles/PMC9014485/ /pubmed/35441154 http://dx.doi.org/10.1016/j.tchem.2022.100012 Text en https://creativecommons.org/licenses/by-nc-nd/4.0/This is an open access article under the CC BY-NC-ND license (http://creativecommons.org/licenses/by-nc-nd/4.0/ (https://creativecommons.org/licenses/by-nc-nd/4.0/) ). |
spellingShingle | Article Alvarado, Jesus I. Martinez Meinhardt, Jonathan M. Lin, Song Working at the interfaces of data science and synthetic electrochemistry |
title | Working at the interfaces of data science and synthetic electrochemistry |
title_full | Working at the interfaces of data science and synthetic electrochemistry |
title_fullStr | Working at the interfaces of data science and synthetic electrochemistry |
title_full_unstemmed | Working at the interfaces of data science and synthetic electrochemistry |
title_short | Working at the interfaces of data science and synthetic electrochemistry |
title_sort | working at the interfaces of data science and synthetic electrochemistry |
topic | Article |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9014485/ https://www.ncbi.nlm.nih.gov/pubmed/35441154 http://dx.doi.org/10.1016/j.tchem.2022.100012 |
work_keys_str_mv | AT alvaradojesusimartinez workingattheinterfacesofdatascienceandsyntheticelectrochemistry AT meinhardtjonathanm workingattheinterfacesofdatascienceandsyntheticelectrochemistry AT linsong workingattheinterfacesofdatascienceandsyntheticelectrochemistry |