Computational Insights into the Regioselectivity of 1,3-Dipolar Cycloadditions inside Carbon Nanotubes-Reference-Cited by-同舟云学术

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Computational Insights into the Regioselectivity of 1,3-Dipolar Cycloadditions inside Carbon Nanotubes

Published:2024-09-01 Issue: Volume: Page:
ISSN:1932-7447
Container-title:The Journal of Physical Chemistry C
language:en
Short-container-title:J. Phys. Chem. C

Author:

Tomasini Michele¹²^ORCID,Marforio Tainah Dorina³^ORCID,Calveresi Matteo³^ORCID,Poater Albert²^ORCID,Poater Jordi⁴⁵^ORCID

Affiliation:

1. Institut de Química Computacional i Catàlisi, Departament de Química, Universitat de Girona, c/Maria Aurèlia Capmany 69, 17003 Girona, Catalonia, Spain

2. Dipartimento di Chimica e Biologia, Università di Salerno, Via Ponte Don Melillo, 84084 Fisciano, Italy

3. Università di Bologna, Via Zamboni 33, 40126 Bologna, Italy

4. Departament de Química Inorgànica i Orgànica & IQTCUB, Universitat de Barcelona, Martí I Franquès 1-11, 08028 Barcelona, Spain

5. ICREA, Pg. Lluís Companys 23, 08010 Barcelona, Spain

Funder

Ministerio de Ciencia e Innovaci?n

Barcelona Supercomputing Center

Generalitat de Catalunya

Instituci? Catalana de Recerca i Estudis Avan?ats

Publisher

American Chemical Society (ACS)

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jpcc.4c03830

Reference101 articles.

1. Origins of stereoselectivity in evolved ketoreductases

2. AlphaFold2 and Deep Learning for Elucidating Enzyme Conformational Flexibility and Its Application for Design

3. Industrial application of solid acid–base catalysts

4. Use of zeolites for greener and more para-selective electrophilic aromatic substitution reactions

5. Biomimetic Reactions Catalyzed by Cyclodextrins and Their Derivatives

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