Pharmacophore based virtual screening, molecular docking, molecular dynamics and MM-GBSA approach for identification of prospective SARS-CoV-2 inhibitor from natural product databases-Reference-Cited by-同舟云学术

Pharmacophore based virtual screening, molecular docking, molecular dynamics and MM-GBSA approach for identification of prospective SARS-CoV-2 inhibitor from natural product databases

Published:2020-09-28 Issue:3 Volume:40 Page:1363-1386
ISSN:0739-1102
Container-title:Journal of Biomolecular Structure and Dynamics
language:en
Short-container-title:Journal of Biomolecular Structure and Dynamics

Author:

Kumar Banoth Karan¹^ORCID,Faheem ¹^ORCID,Sekhar Kondapalli Venkata Gowri Chandra²,Ojha Rupal³^ORCID,Prajapati Vijay Kumar³^ORCID,Pai Aravinda⁴,Murugesan Sankaranarayanan¹^ORCID

Affiliation:

1. Medicinal Chemistry Research Laboratory, Department of Pharmacy, Birla Institute of Technology and Science-Pilani, Pilani, India

2. Department of Chemistry, Birla Institute of Technology and Science-Pilani, Hyderabad, India

3. Department of Biochemistry, School of Life Sciences, Central University of Rajasthan, Kishangarh, India

4. Department of Pharmaceutical Chemistry, Manipal College of Pharmaceutical Sciences (MCOPS); MAHE, Manipal, India

Funder

Department of Biotechnology ,Indo-spain project

Ministry of Tribal Affairs, Government of India

Publisher

Informa UK Limited

Subject

Molecular Biology,General Medicine,Structural Biology

Link

https://www.tandfonline.com/doi/pdf/10.1080/07391102.2020.1824814

Reference59 articles.

1. Epidemiology, causes, clinical manifestation and diagnosis, prevention and control of coronavirus disease (COVID-19) during the early outbreak period: a scoping review

2. AID 651697. (2012). Dose response confirmation of small molecule inhibitors of the catalytic domain of the SUMO protease, SENP1 in a kinetic FRET assay - PubChem.

3. The proximal origin of SARS-CoV-2

4. Sanguinello and Tarocco (Citrus sinensis [L.] Osbeck): Bioactive compounds and colour appearance of blood oranges

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