| Structural benchmarking, density functional theory simulation, spectroscopic investigation and molecular docking of N-(1H-pyrrol-2-yl) methylene)-4-methylaniline as castration … FC Asogwa, EC Agwamba, H Louis, MC Muozie, I Benjamin, TE Gber, ... Chemical Physics Impact 5, 100091, 2022 | 91 | 2022 |
| 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 |
| Probing the Reactions of Thiourea (CH4N2S) with Metals (X = Au, Hf, Hg, Ir, Os, W, Pt, and Re) Anchored on Fullerene Surfaces (C59X) H Louis, DE Charlie, IO Amodu, I Benjamin, TE Gber, EC Agwamba, ... ACS omega 7 (39), 35118-35135, 2022 | 74 | 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 | 71 | 2022 |
| Synthesis, characterization, DFT studies, and molecular modeling of azo dye derivatives as potential candidate for trypanosomiasis treatment EC Agwamba, AD Udoikono, H Louis, EU Udoh, I Benjamin, AT Igbalagh, ... Chemical Physics Impact 4, 100076, 2022 | 68 | 2022 |
| Single crystal investigations, spectral analysis, DFT studies, antioxidants, and molecular docking investigations of novel hexaisothiocyanato chromate complex J Makhlouf, H Louis, I Benjamin, E Ukwenya, A Valkonen, W Smirani Journal of Molecular Structure 1272, 134223, 2023 | 52 | 2023 |
| 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 |
| 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 |
| Hydrogen storage capacity of C12X12 (X= N, P, and Si) HO Edet, H Louis, I Benjamin, M Gideon, TO Unimuke, SA Adalikwu, ... Chemical Physics Impact 5, 100107, 2022 | 47 | 2022 |
| Modelling of aminothiophene-carbonitrile derivatives as potential drug candidates for hepatitis B and C I Benjamin, TE Gber, H Louis, TN Ntui, EI Oyo-Ita, TO Unimuke, MM Edim, ... Iranian Journal of Science and Technology, Transactions A: Science 46 (5 …, 2022 | 45 | 2022 |
| Computational study on the interactions of functionalized C24NC (NC=C, –OH, –NH2, –COOH, and B) with chloroethylphenylbutanoic acid BE Inah, H Louis, I Benjamin, TO Unimuke, AS Adeyinka Canadian Journal of Chemistry 101 (1), 11-24, 2022 | 45 | 2022 |
| Heteroatoms (B, N, S) doped quantum dots as potential drug delivery system for isoniazid: insight from DFT, NCI, and QTAIM HO Edet, H Louis, TE Gber, PS Idante, TGC Egemonye, PB Ashishie, ... Heliyon 9 (1), 2023 | 41 | 2023 |
| Integrated spectroscopic, bio-active prediction and analytics of isoquinoline derivative for breast cancer mitigation CG Apebende, PS Idante, H Louis, US Ameuru, TO Unimuke, TE Gber, ... Chemistry Africa 5 (6), 1979-1995, 2022 | 38 | 2022 |
| (E)-2-((3-nitrophenyl) diazenyl)-3-oxo-3-phenylpropanal: experimental, DFT studies, and molecular docking investigations EC Agwamba, H Louis, I Benjamin, CG Apebende, TO Unimuke, HO Edet, ... Chemistry Africa 5 (6), 2131-2147, 2022 | 32 | 2022 |
| Antitubercolusic potential of amino-(formylphenyl) diazenyl-hydroxyl and nitro-substituted naphthalene-sulfonic acid derivatives: experimental and theoretical investigations EC Agwamba, I Benjamin, H Louis, AD Udoikono, AT Igbalagh, ... Chemistry Africa 5 (5), 1451-1467, 2022 | 32 | 2022 |
| Crystal structure analysis, magnetic measurement, DFT studies, and adsorption properties of novel 1-(2, 5-dimethyphenyl) piperazine tetrachlorocobaltate hydrate C Gharbi, H Louis, IO Amodu, I Benjamin, W Fujita, CB Nasr, L Khedhiri Materials Today Communications 34, 104965, 2023 | 31 | 2023 |
| 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 |
| Sensor behavior of transition-metals (X= Ag, Au, Pd, and Pt) doped Zn11-X-O12 nanostructured materials for the detection of serotonin H Louis, M Patrick, IO Amodu, I Benjamin, IJ Ikot, GE Iniama, AS Adeyinka Materials Today Communications 34, 105048, 2023 | 29 | 2023 |
| Computational study on nickel doped encapsulated Mg, K, Ca on pristine C24 nanocage for gas sensing applications AD Nwagu, H Louis, HO Edet, I Benjamin, VN Osabor, AS Adeyinka Materials Science in Semiconductor Processing 157, 107334, 2023 | 26 | 2023 |
Hitler LouisComputational and Bio-Simulation Research Group, University of Calabar, NigeriaVerified email at unical.edu.ng
