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Bulletin of the National Research Centre|March 17, 2021
In silico identification of compounds from <i>Nigella sativa</i> seed oil as potential inhibitors of SARS-CoV-2 targetsChidi Edbert Duru, Ijeoma Akunna Duru, Abayomi Emmanuel AdegboyegaInformatics in Medicine Unlocked|June 1, 2022
Therapeutic capability of five active compounds in typical African medicinal plants against main proteases of SARS-CoV-2 by computational approachOluwasayo Peter Abodunrin, Olayinka Fisayo Onifade, Abayomi Emmanuel AdegboyegaHeliyon|May 20, 2020
Biochemical evaluation and molecular docking assessment of the anti-inflammatory potential of <i>Phyllanthus nivosus</i> leaf against ulcerative colitisTitilayo Omolara Johnson, Kenneth Daniel Odoh, Charles Obiora Nwonuma, et al.International Journal of Molecular Sciences|March 13, 2025
Rational Design and Optimization of Novel PDE5 Inhibitors for Targeted Colorectal Cancer Therapy: An In Silico ApproachSamson Marvellous Oladeji, Deborah Ngozi Conteh, Lukman Abidemi Bello, et al.Journal of Biomolecular Structure & Dynamics|January 8, 2022
Molecular docking, pharmacophore modelling, MD simulation and <i>in silico</i> ADMET study reveals bitter cola constituents as potential inhibitors of SARS-CoV-2 main protease and RNA dependent-RNA polymeraseAbimbola Peter Oluyori, Bolatito Eunice Olanipekun, Oluyomi Stephen Adeyemi, et al.World Journal of Gastroenterology|January 23, 2023
Modern drug discovery for inflammatory bowel disease: The role of computational methodsTitilayo Omolara Johnson, Augustina Oduje Akinsanmi, Stephen Adakole Ejembi, et al.Biochemistry and Biophysics Reports|December 6, 2021
Biochemical evaluation and molecular docking assessment of <i>Cymbopogon citratus</i> as a natural source of acetylcholine esterase (AChE)- targeting insecticidesTitilayo Omolara Johnson, Oluwafemi Adeleke Ojo, Soala Ikiriko, et al.Toxicology Reports|March 29, 2021
Benzo[a]pyrene and Benzo[a]pyrene-7,8-dihydrodiol-9,10-epoxide induced locomotor and reproductive senescence and altered biochemical parameters of oxidative damage in Canton-S <i>Drosophila melanogaster</i>Titilayo Omolara Johnson, Amos Olalekan Abolaji, Simeon Omale, et al.In Silico Pharmacology|February 24, 2025
Molecular modeling of the interactions of compounds of <i>Irvinga wombulu</i> against dihydrofolate reductase-thymidylate synthase in <i>Plasmodium falciparum</i> towards development of anti-malarial drugAmarachi Chike-Ekwughe, Hassan Taiye Abdulameed, Grace I Adebayo-Gege, et al.Pageof 2