Quantum biochemistry, molecular docking, and dynamics simulation revealed synthetic peptides induced conformational changes affecting the topology of the catalytic site of SARS-CoV-2 main protease-Reference-Cited by-同舟云学术

Quantum biochemistry, molecular docking, and dynamics simulation revealed synthetic peptides induced conformational changes affecting the topology of the catalytic site of SARS-CoV-2 main protease

Published:2021-05-05 Issue: Volume: Page:1-13
ISSN:0739-1102
Container-title:Journal of Biomolecular Structure and Dynamics
language:en
Short-container-title:Journal of Biomolecular Structure and Dynamics

Author:

Amaral Jackson L.¹^ORCID,Oliveira Jose T. A.¹,Lopes Francisco E. S.¹²,Freitas Cleverson D. T.¹,Freire Valder N.³,Abreu Leonardo V.¹,Souza Pedro F. N.¹^ORCID

Affiliation:

1. Department of Biochemistry and Molecular Biology, Federal University of Ceará, Fortaleza, Brazil

2. Center for Permanent Education in Health Care, CEATS/School of Public Health of Ceará-ESP-CE, Fortaleza, Brazil

3. Department of Physics, Federal University of Ceará, Fortaleza, Brazil

Funder

CNPq

CAPES

Publisher

Informa UK Limited

Subject

Molecular Biology,General Medicine,Structural Biology

Link

https://www.tandfonline.com/doi/pdf/10.1080/07391102.2021.1920464

Reference46 articles.

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3. Structural and Evolutionary Analysis Indicate That the SARS-CoV-2 Mpro Is a Challenging Target for Small-Molecule Inhibitor Design

4. Intermolecular interactions of cn-716 and acyl-KR-aldehyde dipeptide inhibitors against Zika virus

5. CDC. (n.d). COVIDView: A weekly surveillance summary of U.S. COVID-19 activity. https://www.cdc.gov/coronavirus/2019-ncov/covid-data/covidview/index.html

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