| Structure-based simulated scanning of rheumatoid arthritis inhibitors: 2D-QSAR, 3D-QSAR, docking, molecular dynamics simulation, and lipophilicity indices calculation EI Edache, A Uzairu, PA Mamza, GA Shallangwa Scientific African 15, e01088, 2022 | 26 | 2022 |
| QSAR, homology modeling, and docking simulation on SARS-CoV-2 and pseudomonas aeruginosa inhibitors, ADMET, and molecular dynamic simulations to find a possible oral lead candidate EI Edache, A Uzairu, PA Mamza, GA Shallangwa Journal of Genetic Engineering and Biotechnology 20 (1), 88, 2022 | 25 | 2022 |
| A Semi-empirical based QSAR study of indole𝜷-Diketo acid, Diketo acid and Carboxamide Derivativesas potent HIV-1 agent Using Quantum Chemical descriptors EI Edache, AJ Uttu, A Oluwaseye, H Samuel, A Abduljelil IOSR Journal of Applied Chemistry (IOSR-JAC) 8 (11), 12-20, 2015 | 23 | 2015 |
| Molecular Docking EI Edache, A Uzairu, PA Mamza, GA Shallangwa, MT Ibrahim Molecular Dynamics Simulation, and MM/GBSA Studies of (N-(4-Carbamoylphenyl …, 2023 | 20 | 2023 |
| A comparative QSAR analysis, 3D-QSAR, molecular docking and molecular design of iminoguanidine-based inhibitors of HemO: A rational approach to antibacterial drug design EI Edache, A Uzairu, PA Mamza, GA Shallangwa Journal of Drugs and Pharmaceutical Science 4 (3), 21-36, 2020 | 17 | 2020 |
| Methimazole and propylthiouracil design as a drug for anti-graves' disease: Structural studies, Hirshfeld surface analysis, DFT calculations, molecular docking, molecular … EI Edache, A Uzairu, PA Mamza, GA Shallangwa, M Azam, K Min Journal of Molecular Structure 1289, 135913, 2023 | 16 | 2023 |
| Docking Simulations and Virtual Screening to find Novel Ligands for T3S in Yersinia pseudotuberculosis YPIII, A drug target for type III secretion (T3S) in the Gram-negative … EI Edache, U Adamu, PA Mamza, SA Gideon Chemical Review and Letters 4 (3), 130-144, 2021 | 16 | 2021 |
| Cheminformatics-based discovery of new organoselenium compounds with potential for the treatment of cutaneous and visceral leishmaniasis FA Ugbe, GA Shallangwa, A Uzairu, I Abdulkadir, EI Edache, AI Al-Megrin, ... Journal of Biomolecular Structure and Dynamics, 2023 | 14 | 2023 |
| Theoretical Investigation of the Cooperation of Iminoguanidine with the Enzymes-Binding Domain of Covid-19 and Bacterial Lysozyme Inhibitors and their Pharmacokinetic Properties EI Edache, A Uzairu, PA Mamza, GA Shallangwa Journal of Mexican Chemical Society 66 (4), 513-542, 2022 | 14 | 2022 |
| Prediction of HemO Inhibitors Based on Iminoguanidine using QSAR, 3DQSAR Study, Molecular Docking, Molecular Dynamic Simulation and ADMET EI Edache, A Uzairu, PA Mamza, GA Shallangwa Journal of Drug Design and Discovery Research 1 (2), 36-52, 2020 | 14 | 2020 |
| Quantitative structure-activity relationship analysis of the anti-tyrosine activity of some tetraketone and benzyl-benzoate derivatives based on genetic algorithm-multiple … EI Edache, DE Arthur, U Abdulfatai Journal of Chemistry and Materials Research 6 (1), 3-13, 2016 | 14 | 2016 |
| Virtual screening, pharmacokinetics, and molecular dynamics simulations studies to identify potent approved drugs for Chlamydia trachomatis treatment EI Edache, A Uzairu, GA Shallangwa, PA Mamza Future Journal of Pharmaceutical Sciences 7, 1-22, 2021 | 12 | 2021 |
| QSAR and Molecular Docking Analysis of Substituted Tetraketone and Benzyl-benzoate Analogs as Anti-tyrosine: A Novel Approach to anti-tyrosine kinase Drug Design and Discovery EI Edache, H Samuel, YI Sulyman, O Arinze, OI Ayine Chemistry Research Journal 5 (6), 79-100, 2020 | 12 | 2020 |
| Evaluation of dimedone-derived compounds as inhibitors against human colon cancer: Insights from 2D-QSAR, ADMET prediction, Osiris, Molinspiration, and molecular modeling K Mkhayar, K Elkhattabi, R Elkhalabi, R Haloui, O Daoui, EI Edache, ... Chinese Journal of Analytical Chemistry 51 (11), 100330, 2023 | 11 | 2023 |
| Docking and Virtual Screening Studies of Tetraketone Derivatives as Tyrosine Kinase (EGFR) Inhibitors: A Rational Approach to Anti-Fungi Drug Design S Shafiu, EI Edache, U Sani, M Abatyough Journal of Pharmaceutical and Medicinal Research 3 (1), 78-80, 2017 | 11 | 2017 |
| In-silico discovery and simulated selection of multi-target Anti-HIV-1 inhibitors EI Edache, HU Hambali, DE Arthur, A Oluwaseye, OC Chinweuba Int Res J Pure Appl Chem 11 (1), 1-15, 2016 | 11 | 2016 |
| Computational evaluation of the inhibitory potential of some urea, thiourea, and selenourea derivatives of diselenides against leishmaniasis: 2D-QSAR, pharmacokinetics … FA Ugbe, EI Edache, SE Adeniji, DE Arthur, A Ajala, SN Adawara, S Ejeh, ... Journal of Molecular Structure 1302, 137473, 2024 | 10 | 2024 |
| 3D-QSAR, Molecular Docking, Molecular Dynamics Simulations and Structural Studies of Some Selected Inhibitors of the Glycoprotein (GPC) of Lassa Virus EI Edache, HA Dawi, FA Ugbe Journal of Applied Organometallic Chemistry 3 (3), 224-244, 2023 | 10 | 2023 |
| Investigation of 5, 6-dihydro-2-pyrones derivatives as potent anti-HIV agents inhibitors EI Edache, A Uzairu, SE Abeche J Comput Methods Mol Des 5 (3), 135-149, 2015 | 10 | 2015 |
| (S)-N-(4-Carbamoylphenyl)-8-Cyclopropyl-7-(Naphthalen-1-ylmethyl)-5-Oxo-2, 3-Dihydro-5H-Thiazolo [3, 2-a] Pyridine-3-Carboxamide, A Better Inhibitor of SARS-Cov-2 Spike … EI Edache, A Uzairu, GA Shallangwa, PA Mamza Advanced Journal of Chemistry, Section A 6 (1), 17-30, 2023 | 9 | 2023 |
Adamu UzairuDepartment of Chemistry, Ahmadu Bello University, Zaria, NigeriaEmail yang diverifikasi di abu.edu.ng
