Assessing the inhibitory potential of anti-dengue compounds against Japanese encephalitis virus RNA dependent RNA polymerase: an in silico study-Reference-Cited by-同舟云学术

Assessing the inhibitory potential of anti-dengue compounds against Japanese encephalitis virus RNA dependent RNA polymerase: an in silico study

Published:2023-10-09 Issue: Volume: Page:1-17
ISSN:0739-1102
Container-title:Journal of Biomolecular Structure and Dynamics
language:en
Short-container-title:Journal of Biomolecular Structure and Dynamics

Author:

Bajrai Leena H.¹²,Alandijany Thamir A.¹³,Alsaady Isra¹³,El-Daly Mai M.¹³,Tolah Ahmed M.¹⁴,Khateb Aiah M.¹⁵,Dubey Amit⁶,Dwivedi Vivek Dhar⁷⁸^ORCID,Azhar Esam I.¹³^ORCID

Affiliation:

1. Special Infectious Agents Unit-BSL3, King Fahd Medical Research Center, King Abdulaziz University, Jeddah, Saudi Arabia

2. Biochemistry Department, Faculty of Sciences, King Abdulaziz University, Jeddah, Saudi Arabia

3. Department of Medical Laboratory Sciences, Faculty of Applied Medical Sciences, King Abdulaziz University, Jeddah, Saudi Arabia

4. Department of Medical Laboratory Technology, Faculty of Applied Medical Sciences, King Abdulaziz University, Rabig, Saudi Arabia

5. Department of Medical Laboratory Technology, College of Applied Medical Sciences, Taibah University, Madinah, Saudi Arabia

6. Computational Chemistry & Drug Discovery Division, Quanta Calculus, Greater Noida, India

7. Bioinformatics Research Division, Quanta Calculus, Greater Noida, India

8. Center for Global Health Research, Saveetha Institute of Medical and Technical Sciences, Saveetha Medical College and Hospitals, Saveetha University, Chennai, Tamil Nadu, India

Publisher

Informa UK Limited

Subject

Molecular Biology,General Medicine,Structural Biology

Link

https://www.tandfonline.com/doi/pdf/10.1080/07391102.2023.2265489

Reference34 articles.

1. Towards the discovery of potential RdRp inhibitors for the treatment of COVID-19: structure guided virtual screening, computational ADME and molecular dynamics study

2. Investigating the Mechanism of Action of Anti-Dengue Compounds as Potential Binders of Zika Virus RNA-Dependent RNA Polymerase

3. The Protein Data Bank

4. Scalable Algorithms for Molecular Dynamics Simulations on Commodity Clusters

5. Drug-like Bioactive Structures and Conformational Coverage with the LigPrep/ConfGen Suite: Comparison to Programs MOE and Catalyst

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