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Homology Modeling and Molecular Dynamics-Driven Search for Natural Inhibitors That Universally Target Receptor-Binding Domain of Spike Glycoprotein in SARS-CoV-2 Variants.
Molecules. 2022 Oct 28;27(21):7336. doi: 10.3390/molecules27217336.
Molecules. 2022.
PMID: 36364158
Free PMC article.
In Silico Study on Natural Chemical Compounds from Citric Essential Oils as Potential Inhibitors of an Omicron (BA.1) SARS-CoV-2 Mutants' Spike Glycoprotein.
Ovchynnykova O, Booth JD, Cocroft TM, Sukhyy KM, Kapusta K.
Ovchynnykova O, et al. Among authors: sukhyy km.
Curr Comput Aided Drug Des. 2024 Jan 4. doi: 10.2174/0115734099275132231213055138. Online ahead of print.
Curr Comput Aided Drug Des. 2024.
PMID: 38178668
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