Withanolides of <i>Athenaea velutina</i> with potential inhibitory properties against SARS coronavirus main protease (m <sup>pro</sup> ): molecular modeling studies-Reference-Cited by-同舟云学术

Withanolides of Athenaea velutina with potential inhibitory properties against SARS coronavirus main protease (m ^pro ): molecular modeling studies

Published:2023-01-23 Issue:21 Volume:41 Page:12267-12275
ISSN:0739-1102
Container-title:Journal of Biomolecular Structure and Dynamics
language:en
Short-container-title:Journal of Biomolecular Structure and Dynamics

Author:

Abreu Alves Pabllo¹²^ORCID,Dantas Rocha Késya Amanda²^ORCID,Bezerra Lucas Lima¹^ORCID,Ayala Alejandro Pedro³^ORCID,Vieira Monteiro Norberto de Kássio¹^ORCID,Pessoa Otília Deusdênia Loiola²^ORCID

Affiliation:

1. Departamento de Química Analítica e Físico Química, Centro de Ciências, Universidade Federal do Ceará, Fortaleza, CE, Brazil

2. Departamento de Química Orgânica e Inorgânica, Centro de Ciências, Universidade Federal do Ceará, Fortaleza, CE, Brazil

3. Departamento de Física, Centro de Ciências, Universidade Federal do Ceará, Fortaleza, CE, Brazil

Funder

CNPq

Publisher

Informa UK Limited

Subject

Molecular Biology,General Medicine,Structural Biology

Link

https://www.tandfonline.com/doi/pdf/10.1080/07391102.2023.2167863

Reference49 articles.

1. Antiproliferative Effects of Withanolides from Withania adpressa

2. Inhibition mechanism of SARS-CoV-2 main protease by ebselen and its derivatives

3. Mechanism of inhibition of SARS-CoV-2 Mpro by N3 peptidyl Michael acceptor explained by QM/MM simulations and design of new derivatives with tunable chemical reactivity

4. Preface

5. Front Matter

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