Yemi A Adekunle

5PUBLICATIONS
38CO-AUTHORS
Cheminformatics and quantitative structure-activity relationshipsComputational chemistryBiologically active molecules
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Publications (5)

|Sep 19, 2026
Integration of network pharmacology, structure-based pharmacophore modeling, DFT, molecular docking, and molecular dynamics simulations to identify multi-target small molecule inhibitors against Alzheimer's disease.

|Aug 25, 2026
Computational applications in secondary metabolite discovery (CAiSMD) 2026: focus on secondary metabolites towards drug discovery.

|Jan 11, 2025
Isolation, cytotoxicity evaluation, and molecular docking of 3,4,3'-tri-O-methylflavellagic acid from Anogeissus leiocarpus (DC.) Guill. & Perr. root.

Yemi A Adekunle, Babatunde B Samuel, Chinemenma M Ezeude

|Nov 01, 2024
Oleanolic acid purified from the stem bark of Olax subscorpioidea Oliv. inhibits the function and catalysis of human 17β-hydroxysteroid dehydrogenase 1.

Yemi A Adekunle, Babatunde B Samuel, Wande M Oluyemi

|Jan 04, 2022
An Allosteric Inhibitory Potential of Triterpenes from Combretum racemosum on the Structural and Functional Dynamics of Plasmodium falciparum Lactate Dehydrogenase Binding Landscape.

Wande M Oluyemi, Babatunde B Samuel, Adeniyi T Adewumi

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Frequent Collaborators

2 joint publications

Wande M Oluyemi

2 joint publications

Adeniyi T Adewumi

2 joint publications

Babatunde B Samuel

2 joint publications

Lutfun Nahar