| Understanding the lithiation mechanisms of pyrenetetrone-based carbonyl compound as cathode material for lithium-ion battery: Insight from first principle density functional theory H Louis, TE Gber, FC Asogwa, EA Eno, TO Unimuke, VM Bassey, BI Ita Materials Chemistry and Physics 278, 125518, 2022 | 97 | 2022 |
| Reactivity, stability, and thermodynamics of para-methylpyridinium-based ionic liquids: Insight from DFT, NCI, and QTAIM EA Eno, H Louis, TO Unimuke, TE Gber, IJ Mbonu, CJ Ndubisi, ... Journal of Ionic Liquids 2 (1), 100030, 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 | 82 | 2022 |
| Antimicrobial activities of 1-phenyl-3-methyl-4-trichloroacetyl-pyrazolone: Experimental, DFT studies, and molecular docking investigation EA Eno, JI Mbonu, H Louis, FS Patrick-Inezi, TE Gber, TO Unimuke, ... Journal of the Indian Chemical Society 99 (7), 100524, 2022 | 73 | 2022 |
| Reactive azo compounds as a potential chemotherapy drugs in the treatment of malignant glioblastoma (GBM): Experimental and theoretical studies AD Udoikono, H Louis, EA Eno, EC Agwamba, TO Unimuke, AT Igbalagh, ... Journal of Photochemistry and Photobiology 10, 100116, 2022 | 71 | 2022 |
| Meta-hybrid density functional theory prediction of the reactivity, stability, and IGM of azepane, oxepane, thiepane, and halogenated cycloheptane TO Unimuke, H Louis, EA Eno, EC Agwamba, AS Adeyinka ACS omega 7 (16), 13704-13720, 2022 | 62 | 2022 |
| Experimental and computational modeling of the biological activity of benzaldehyde sulphur trioxide as a potential drug for the treatment of Alzheimer disease EA Eno, H Louis, P Ekoja, I Benjamin, SA Adalikwu, MM Orosun, ... Journal of the Indian Chemical Society 99 (7), 100532, 2022 | 51 | 2022 |
| Antispasmodic activity of carnosic acid extracted from rosmarinus officinalis: Isolation, spectroscopic characterization, DFT studies, and in silico molecular docking … K Wei, H Louis, W Emori, PS Idante, EC Agwamba, CR Cheng, EA Eno, ... Journal of Molecular Structure 1260, 132795, 2022 | 49 | 2022 |
| Synthesis, characterization, and theoretical studies of the photovoltaic properties of novel reactive azonitrobenzaldehyde derivatives H Louis, IB Onyebuenyi, JO Odey, AT Igbalagh, MJT Mbonu, EA Eno, ... RSC advances 11 (45), 28433-28446, 2021 | 46 | 2021 |
| Theoretical investigation and antineoplastic potential of Zn (II) and Pd (II) complexes of 6-methylpyridine-2-carbaldehyde-N (4)-ethylthiosemicarbazone EA Eno, FA Patrick-Inezi, H Louis, TE Gber, TO Unimuke, EC Agwamba, ... Chemical Physics Impact 5, 100094, 2022 | 35 | 2022 |
| Investigation on electronic structure, vibrational spectra, NBO analysis, and molecular docking studies of aflatoxins and selected emerging mycotoxins against wild-type … JA Agwupuye, PA Neji, H Louis, JO Odey, TO Unimuke, EA Bisiong, ... Heliyon 7 (7), 2021 | 34 | 2021 |
| 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 | 32 | 2022 |
| Transition Metal-Decorated B12N12–X (X = Au, Cu, Ni, Os, Pt, and Zn) Nanoclusters as Biosensors for Carboplatin I Benjamin, H Louis, GA Okon, SW Qader, LE Afahanam, CF Fidelis, ... ACS omega 8 (11), 10006-10021, 2023 | 29 | 2023 |
| Therapeutic Potential of B12N12-X (X = Au, Os, and Pt) Nanostructured as Effective Fluorouracil (5Fu) Drug Delivery Materials K Chukwuemeka, H Louis, I Benjamin, PA Nyong, EU Ejiofor, EA Eno, ... ACS Applied Bio Materials 6 (3), 1146-1160, 2023 | 27 | 2023 |
| Adsorption and gas-sensing investigation of oil dissolved gases onto nitrogen and sulfur doped graphene quantum dots BE Inah, JF Eze, H Louis, HO Edet, TE Gber, EA Eno, AN Etim, ... Chemical Physics Impact 7, 100265, 2023 | 25 | 2023 |
| Kinetic and thermodynamic evaluation of azithromycin as a green corrosion inhibitor during acid cleaning process of mild steel using an experimental and theoretical approach AI Ikeuba, JE Ntibi, PC Okafor, BI Ita, AU Agobi, FC Asogwa, BJ Omang, ... Results in Chemistry 5, 100909, 2023 | 24 | 2023 |
| Synthesis, stereochemistry and antimicrobial activity of copper (II) and nickel (II) complexes of 4-phenylsemicarbazones EN Nfor, SN Esemu, GA Ayimele, EA Eno, GE Iniama, OE Offiong Bulletin of the Chemical Society of Ethiopia 25 (3), 2011 | 24 | 2011 |
| Detection of hydrogen fluoride (HF) gas by Mg12O11-X (X= S, P, N, and B) nanosurfaces SA Adalikwu, H Louis, HO Edet, I Benjamin, TGC Egemonye, EA Eno, ... Chemical Physics Impact 5, 100129, 2022 | 22 | 2022 |
| Detection of Carbon, Sulfur, and Nitrogen Dioxide Pollutants with a 2D Ca12O12 Nanostructured Material H Louis, TGC Egemonye, TO Unimuke, BE Inah, HO Edet, EA Eno, ... ACS omega 7 (39), 34929-34943, 2022 | 21 | 2022 |
| Modeling of Re (I) tricarbonyl complexes against SARS-CoV-2 receptor via DFT, in-silico molecular docking, and QSAR EA Eno, H Louis, TO Unimuke, TE Gber, JA Akpanke, IO Amodu, ... Chemical Physics Impact 5, 100105, 2022 | 20 | 2022 |
Tomsmith O. UnimukePhD Candidate-Chemical and and Biomolecular Engineering, The University of Sydney, Australia在 uni.sydney.edu.au 的电子邮件经过验证
