| Antimalarial potential of naphthalene-sulfonic acid derivatives: Molecular electronic properties, vibrational assignments, and in-silico molecular docking studies I Benjamin, AD Udoikono, H Louis, EC Agwamba, TO Unimuke, AE Owen, ... Journal of Molecular Structure 1264, 133298, 2022 | 85 | 2022 |
| Heteroatoms (Si, B, N, and P) doped 2D monolayer MoS 2 for NH 3 gas detection TE Gber, H Louis, AE Owen, BE Etinwa, I Benjamin, FC Asogwa, ... RSC advances 12 (40), 25992-26010, 2022 | 80 | 2022 |
| Adsorption properties of metal functionalized fullerene (C59Au, C59Hf, C59Ag, and C59Ir) nanoclusters for application as a biosensor for hydroxyurea (HXU … CG Apebende, H Louis, AE Owen, I Benjamin, IO Amodu, TE Gber, ... Zeitschrift für Physikalische Chemie 236 (11-12), 1515-1546, 2022 | 49 | 2022 |
| Molecular modeling of the spectroscopic, structural, and bioactive potential of tetrahydropalmatine: insight from experimental and theoretical approach W Emori, H Louis, SA Adalikwu, RA Timothy, CR Cheng, TE Gber, ... Polycyclic Aromatic Compounds 43 (7), 5958-5975, 2023 | 45 | 2023 |
| Computational design and molecular modeling of the interaction of nicotinic acid hydrazide nickel-based complexes with H 2 S gas H Louis, D Etiese, TO Unimuke, AE Owen, AO Rajee, TE Gber, CM Chima, ... RSC advances 12 (47), 30365-30380, 2022 | 30 | 2022 |
| Manganese-catalyzed dehydrogenative synthesis of urea derivatives and polyureas AE Owen, A Preiss, A McLuskie, C Gao, G Peters, M Bühl, A Kumar ACS Catalysis 12 (12), 6923-6933, 2022 | 21 | 2022 |
| Density functional theory (DFT) computation of pristine and metal-doped MC59 (M= Au, Hf, Hg, Ir) fullerenes as nitrosourea drug delivery systems CG Apebende, GJ Ogunwale, H Louis, I Benjamin, MT Kadiri, AE Owen, ... Materials Science in Semiconductor Processing 158, 107362, 2023 | 20 | 2023 |
| Isolation, characterization, molecular electronic structure investigation, and in-silico modeling of the anti-inflammatory potency of trihydroxystilbene H Louis, GE Mathias, TO Unimuke, W Emori, L Ling, AE Owen, ... Journal of Molecular Structure 1266, 133418, 2022 | 20 | 2022 |
| Hydrogen storage capacity of Al, Ca, Mg, Ni, and Zn decorated phosphorus-doped graphene: Insight from theoretical calculations IJ Ikot, PO Olagoke, H Louis, DE Charlie, TO Magu, AE Owen International Journal of Hydrogen Energy 48 (36), 13362-13376, 2023 | 17 | 2023 |
| Antihypotensive potency of p-synephrine: Spectral analysis, molecular properties and molecular docking investigation AE Owen, H Louis, EC Agwamba, AD Udoikono, ALE Manicum Journal of Molecular Structure 1273, 134233, 2023 | 17 | 2023 |
| Assessing the Performance of Al12N12 and Al12P12 Nanostructured Materials for Alkali Metal Ion (Li, Na, K) Batteries H Louis, EE Ekereke, BB Isang, AI Ikeuba, IO Amodu, TE Gber, AE Owen, ... ACS omega 7 (50), 46183-46202, 2022 | 16 | 2022 |
| Antibacterial potential of trihydroxycyclohexa-2, 4-diene-1-carboxylic acid: Insight from DFT, molecular docking, and molecular dynamic simulation AE Owen, CM Chima, I Ahmad, W Emori, EC Agwamba, CR Cheng, ... Polycyclic Aromatic Compounds, 1-24, 2023 | 14 | 2023 |
| Spectroscopic characterization, polar solvation effects, DFT studies, and the antiviral inhibitory potency of a novel terpolymer based on p-Phenylenediamine–Guanidine … N Mujafarkani, MA Ojong, AJ Ahamed, I Benjamin, OC Ngana, FO Akor, ... Journal of Molecular Structure 1292, 136049, 2023 | 13 | 2023 |
| Interaction of 5-Fluorouracil on the Surfaces of Pristine and Functionalized Ca12O12 Nanocages: An Intuition from DFT GJ Ogunwale, H Louis, TO Unimuke, GE Mathias, AE Owen, HO Edet, ... ACS omega 8 (15), 13551-13568, 2023 | 10 | 2023 |
| X-ray crystallography, molecular structure investigation, quantum chemical studies, and molecular dynamic of rheosmin as inhibitors of hemorrhagic Lassa Virus EL Kechi, BE Inah, OC Godfrey, UO Edet, EE Antai, OJ Ikenyirimba, ... Journal of Molecular Structure 1292, 136048, 2023 | 7 | 2023 |
| Natural Andrographolide Isolated from Andrographis paniculata as Potent Epileptic Agent: Spectroscopy, Molecular Structure, and Molecular Docking Investigation AE Owen, H Louis, EU Ejiofor, W Emori, TE Gber, I Benjamin, CR Cheng, ... Chemistry Africa 6 (5), 2445-2461, 2023 | 7 | 2023 |
| Synthesis of polyethyleneimines from the manganese‐catalysed coupling of ethylene glycol and ethylenediamine CN Brodie, AE Owen, JS Kolb, M Bühl, A Kumar Angewandte Chemie International Edition 62 (29), e202306655, 2023 | 7 | 2023 |
| Investigation of the Anti-Plasmodial Properties of N-2-Oxo Pyrrolidine Pentanamide-Based Sulfonamides: Experimental and Theoretical Approach FC Asogwa, O C. Ekoh, D I. Ugwu, EC Agwamba, H Louis, F U. Eze, ... Polycyclic Aromatic Compounds, 1-20, 2023 | 7 | 2023 |
| Anti-inflammatory, Immunomodulatory and DFT Evaluation of the Reactivity Indexes of Phytochemicals Isolated from Harungana madagascariensis FC Asogwa, CG Apebende, GW Ugodi, P Ebo, H Louis, AI Ikeuba, ... Chemistry Africa 6 (3), 1349-1361, 2023 | 7 | 2023 |
| Synthesis, characterization, DFT studies and molecular docking investigation of 2-oxo-ethyl piperidine pentanamide-derived sulfonamides as anti-diabetic agents FC Asogwa, EC Ogechi, H Louis, UD Izuchukwu, CG Apebende, ... Results in Chemistry 4, 100672, 2022 | 5 | 2022 |
Adedapo AdeyinkaUniversity of JohannesburgVerified email at uj.ac.za
