Exploration of Anti-HIV Phytocompounds against SARS-CoV-2 Main Protease: Structure-Based Screening, Molecular Simulation, ADME Analysis and Conceptual DFT Studies

The ever-expanding pandemic severe acute respiratory syndrome coronavirus 2 (SARS-CoV-2) infection has gained attention as COVID-19 and caused an emergency in public health to an unmatched level to date. However, the treatments used are the only options; currently, no effective and licensed medicati...

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Detalles Bibliográficos
Autores principales: Murali, Mahadevamurthy, Gowtham, Hittanahallikoppal Gajendramurthy, Shilpa, Natarajamurthy, Krishnappa, Hemanth Kumar Naguvanahalli, Ledesma, Ana E., Jain, Anisha S., Shati, Ali A., Alfaifi, Mohammad Y., Elbehairi, Serag Eldin I., Achar, Raghu Ram, Silina, Ekaterina, Stupin, Victor, Ortega-Castro, Joaquín, Frau, Juan, Flores-Holguín, Norma, Amruthesh, Kestur Nagaraj, Shivamallu, Chandan, Kollur, Shiva Prasad, Glossman-Mitnik, Daniel
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2022
Materias:
Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9736867/
https://www.ncbi.nlm.nih.gov/pubmed/36500380
http://dx.doi.org/10.3390/molecules27238288

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9736867/
https://www.ncbi.nlm.nih.gov/pubmed/36500380
http://dx.doi.org/10.3390/molecules27238288

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