Computational Prediction of the Potential Target of SARS‐CoV‐2 Inhibitor Plitidepsin via Molecular Docking, Dynamic Simulations and MM‐PBSA Calculations-Reference-Cited by-同舟云学术

Computational Prediction of the Potential Target of SARS‐CoV‐2 Inhibitor Plitidepsin via Molecular Docking, Dynamic Simulations and MM‐PBSA Calculations

Published:2022-01-04 Issue: Volume: Page:
ISSN:1612-1872
Container-title:Chemistry & Biodiversity
language:en
Short-container-title:Chemistry & Biodiversity

Author:

El Hassab Mahmoud A.¹^ORCID,Hemeda Loah R.²,Elsayed Zainab M.³,Al‐Rashood Sara T.⁴,Abdel‐Hamid Amin Mohammed K.⁵,Abdel‐Aziz Hatem A.⁶,Eldehna Wagdy M.⁷

Affiliation:

1. Department of medicinal Chemistry Faculty of Pharmacy King Salman international University (KSIU) South Sinai Egypt

2. Department of Medicinal Chemistry Faculty of Pharmacy Beni-Suef University Beni-Suef 62514 Egypt

3. Scientific research and innovation support unit Faculty of Pharmacy Kafrelsheikh University Kafrelsheikh P.O. Box33516 Egypt

4. Department of Pharmaceutical Chemistry College of Pharmacy King Saud University P.O. Box 2457 Riyadh 11451 Saudi Arabia

5. South Metropolitan Health Service Murdoch WA 6150 Australia

6. Department of Applied Organic Chemistry National Research Center Dokki, Giza P.O. Box 12622 Egypt

7. Department of Pharmaceutical Chemistry Faculty of Pharmacy Kafrelsheikh University Kafrelsheikh P.O. Box 33516 Egypt

Publisher

Wiley

Subject

Molecular Biology,Molecular Medicine,General Chemistry,Biochemistry,General Medicine,Bioengineering

Link

https://onlinelibrary.wiley.com/doi/pdf/10.1002/cbdv.202100719

Reference35 articles.

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2. Novel Wuhan (2019-nCoV) Coronavirus

3. Bioinformatic analysis and identification of single-stranded RNA sequences recognized by TLR7/8 in the SARS-CoV-2, SARS-CoV, and MERS-CoV genomes

4. Epidemiology, Genetic Recombination, and Pathogenesis of Coronaviruses

5. WHO (2020).’Solidarity’ clinical trial for COVID-19 treatments.

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