| Comparing the suitability of autodock, gold and glide for the docking and predicting the possible targets of Ru (II)-based complexes as anticancer agents AA Adeniyi, PA Ajibade Molecules 18 (4), 3760-3778, 2013 | 87 | 2013 |
| Exploration of chlorinated thienyl chalcones: A new class of monoamine oxidase-B inhibitors B Mathew, A Haridas, G Uçar, I Baysal, AA Adeniyi, MES Soliman, M Joy, ... International journal of biological macromolecules 91, 680-695, 2016 | 76 | 2016 |
| New drug design with covalent modifiers AA Adeniyi, R Muthusamy, MES Soliman Expert opinion on drug discovery 11 (1), 79-90, 2016 | 45 | 2016 |
| Pharmacophore-based 3D-QSAR analysis of thienyl chalcones as a new class of human MAO-B inhibitors: investigation of combined quantum chemical and molecular dynamics approach B Mathew, AA Adeniyi, S Dev, M Joy, G Ucar, GE Mathew, A Singh-Pillay, ... The Journal of Physical Chemistry B 121 (6), 1186-1203, 2017 | 42 | 2017 |
| Cyclic Voltammetric Study of 2‐Hydroxybenzophenone (HBP) Derivatives and the Correspondent Change in the Orbital Energy Levels in Different Solvents AA Adeniyi, TL Ngake, J Conradie Electroanalysis 32 (12), 2659-2668, 2020 | 40 | 2020 |
| Anti-oxidant behavior of functionalized chalcone-a combined quantum chemical and crystallographic structural investigation B Mathew, AA Adeniyi, M Joy, GE Mathew, A Singh-Pillay, ... Journal of Molecular Structure 1146, 301-308, 2017 | 40 | 2017 |
| Implementing QM in docking calculations: is it a waste of computational time? AA Adeniyi, MES Soliman Drug Discovery Today 22 (8), 1216-1223, 2017 | 40 | 2017 |
| Immunoinformatics prediction of overlapping CD8+ T-cell, IFN-γ and IL-4 inducer CD4+ T-cell and linear B-cell epitopes based vaccines against COVID-19 (SARS-CoV-2) AJ Fatoba, L Maharaj, VT Adeleke, M Okpeku, AA Adeniyi, MA Adeleke Vaccine 39 (7), 1111-1121, 2021 | 29 | 2021 |
| Influence of substituents on the reduction potential and pKa values of β-diketones tautomers: A theoretical study AA Adeniyi, J Conradie Electrochimica Acta 297, 947-960, 2019 | 23 | 2019 |
| Exploring the ruthenium-ligands bond and their relative properties at different computational methods AA Adeniyi, PA Ajibade Journal of Chemistry 2016, 2016 | 23 | 2016 |
| Functionalized naphthalimide-4-aminoquinoline conjugates as promising antiplasmodials, with mechanistic insights Shalini, J Legac, AA Adeniyi, P Kisten, PJ Rosenthal, P Singh, V Kumar ACS Medicinal Chemistry Letters 11 (2), 154-161, 2020 | 21 | 2020 |
| Inhibitory activities and possible anticancer targets of Ru (II)-based complexes using computational docking method AA Adeniyi, PA Ajibade Journal of Molecular Graphics and Modelling 38, 60-69, 2012 | 16 | 2012 |
| Design, synthesis, heme binding and density functional theory studies of isoindoline-dione-4-aminoquinolines as potential antiplasmodials A Rani, S Kumar, J Legac, AA Adeniyi, P Awolade, P Singh, PJ Rosenthal, ... Future Medicinal Chemistry 12 (3), 193-205, 2020 | 15 | 2020 |
| Diabetes mellitus caused by mutations in human insulin: analysis of impaired receptor binding of insulins Wakayama, Los Angeles and Chicago using … MA Islam, S Bhayye, AA Adeniyi, MES Soliman, TS Pillay Journal of Biomolecular Structure and Dynamics 35 (4), 724-737, 2017 | 15 | 2017 |
| Development of ruthenium-based complexes as anticancer agents: Toward a rational design of alternative receptor targets AA Adeniyi, PA Ajibade Reviews in Inorganic Chemistry 36 (2), 53-75, 2016 | 15 | 2016 |
| An insight into the anticancer activities of Ru (II)-based metallocompounds using docking methods AA Adeniyi, PA Ajibade Molecules 18 (9), 10829-10856, 2013 | 15 | 2013 |
| Designing multiepitope-based vaccine against Eimeria from immune mapped protein 1 (IMP-1) antigen using immunoinformatic approach T Madlala, VT Adeleke, AJ Fatoba, M Okpeku, AA Adeniyi, MA Adeleke Scientific Reports 11 (1), 18295, 2021 | 14 | 2021 |
| Computational insight into the contribution of para-substituents on the reduction potential, proton affinity, and electronic properties of nitrobenzene compounds AA Adeniyi, J Conradie Journal of Molecular Modeling 25, 1-20, 2019 | 14 | 2019 |
| The anticancer activities of some nitrogen donor ligands containing bis-pyrazole, bipyridine, and phenanthroline moiety using docking methods AA Adeniyi, PA Ajibade Bioinorganic Chemistry and Applications 2018, 2018 | 13 | 2018 |
| Immunoinformatics approach for multi-epitope vaccine design against P. falciparum malaria L Maharaj, VT Adeleke, AJ Fatoba, AA Adeniyi, SI Tshilwane, MA Adeleke, ... Infection, Genetics and Evolution 92, 104875, 2021 | 12 | 2021 |
Peter A. Ajibade, FRSCProfessor of Inorganic Materials Chemistry, University of KwaZulu-NatalVerified email at ukzn.ac.za
