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Molecular docking, pharmacophore modelling, MD simulation and in silico ADMET study reveals bitter cola constituents as potential inhibitors of SARS-CoV-2 main protease and RNA dependent-RNA polymerase.

Authors :
Oluyori, Abimbola Peter
Olanipekun, Bolatito Eunice
Adeyemi, Oluyomi Stephen
Egharevba, Godshelp Osas
Adegboyega, Abayomi Emmanuel
Oladeji, Oluwole Solomon
Source :
Journal of Biomolecular Structure & Dynamics; Mar2023, Vol. 41 Issue 4, p1510-1525, 16p
Publication Year :
2023

Details

Language :
English
ISSN :
07391102
Volume :
41
Issue :
4
Database :
Complementary Index
Journal :
Journal of Biomolecular Structure & Dynamics
Publication Type :
Academic Journal
Accession number :
161365048
Full Text :
https://doi.org/10.1080/07391102.2021.2024883