Screening of Severe Acute Respiratory Syndrome Coronavirus 2 RNA-Dependent RNA Polymerase Inhibitors Using Computational Approach-Reference-Cited by-同舟云学术

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Screening of Severe Acute Respiratory Syndrome Coronavirus 2 RNA-Dependent RNA Polymerase Inhibitors Using Computational Approach

Published:2021-12-01 Issue:12 Volume:28 Page:1228-1247
ISSN:1557-8666
Container-title:Journal of Computational Biology
language:en
Short-container-title:Journal of Computational Biology

Author:

Dhankhar Poonam¹^ORCID,Dalal Vikram²,Kumar Viney³^ORCID

Affiliation:

1. Department of Medicinal Chemistry, Virginia Commonwealth University, Richmond, Virginia, USA.

2. Department of Anesthesiology, Washington University in St. Louis, St. Louis, Missouri, USA.

3. Department of Biotechnology, Indian Institute of Technology, Roorkee, India.

Publisher

Mary Ann Liebert Inc

Subject

Computational Theory and Mathematics,Computational Mathematics,Genetics,Molecular Biology,Modeling and Simulation

Link

https://www.liebertpub.com/doi/pdf/10.1089/cmb.2020.0639

Reference73 articles.

1. Crystal structure of the RNA-dependent RNA polymerase of hepatitis C virus

2. Biochemical characterization of a recombinant SARS coronavirus nsp12 RNA-dependent RNA polymerase capable of copying viral RNA templates

3. DINC 2.0: A New Protein–Peptide Docking Webserver Using an Incremental Approach

4. Remdesivir for the Treatment of Covid-19 — Final Report

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1. Anti-Viral Activity of Bioactive Molecules of Silymarin against COVID-19 via In Silico Studies;Pharmaceuticals;2023-10-17

2. A Computational Workflow to Predict Biological Target Mutations: The Spike Glycoprotein Case Study;Molecules;2023-10-14

3. Combining docking, molecular dynamics simulations, AD-MET pharmacokinetics properties, and MMGBSA calculations to create specialized protocols for running effective virtual screening campaigns on the autoimmune disorder and SARS-CoV-2 main protease;Frontiers in Molecular Biosciences;2023-09-01

4. Investigation of Iminosugars as Antiviral Agents against SARS-CoV-2 Main Protease: Inhibitor Design and Optimization, Molecular Docking, and Molecular Dynamics Studies to Explore Potential Inhibitory Effect of 1-Deoxynojirmycin Series;Current Computer-Aided Drug Design;2023-08-23

5. Deep Drug Discovery of Mac Domain of SARS-CoV-2 (WT) Spike Inhibitors: Using Experimental ACE2 Inhibition TR-FRET Assay, Screening, Molecular Dynamic Simulations and Free Energy Calculations;Bioengineering;2023-08-14

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