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Molecules (Basel, Switzerland)|February 27, 2026
Advancing the Frontiers: Contemporary Achievements and Future Directions in Density Functional Theory CalculationsAleksandr S Kazachenko, Noureddine IssaouiJournal of Molecular Modeling|May 31, 2020
Intermolecular hydrogen bond interactions in the thiourea/water complexes (Thio-(H<sub>2</sub>O)<sub>n</sub>) (n = 1, …, 5): X-ray, DFT, NBO, AIM, and RDG analysesFeride Akman, Noureddine Issaoui, Aleksandr S KazachenkoMolecules (Basel, Switzerland)|September 23, 2022
An Experimental and Theoretical Study on Essential Oil of <i>Aethionema sancakense</i>: Characterization, Molecular Properties and RDG AnalysisAzize Demirpolat, Feride Akman, Aleksandr S KazachenkoMolecules (Basel, Switzerland)|March 29, 2023
Molecular Structure, Spectral Analysis, Molecular Docking and Physicochemical Studies of 3-Bromo-2-hydroxypyridine Monomer and Dimer as Bromodomain InhibitorsNizar Lefi, Aleksandr S Kazachenko, Murugesan Raja, et al.Journal of King Saud University. Science|June 23, 2023
Synthesis, characterization and identification of inhibitory activity on the main protease of COVID-19 by molecular docking strategy of (4-oxo-piperidinium ethylene acetal) trioxonitrateSofian Gatfaoui, Noureddine Issaoui, Aleksandr S Kazachenko, et al.Molecules (Basel, Switzerland)|March 29, 2023
Molecular Structure, Electronic Properties, Reactivity (ELF, LOL, and Fukui), and NCI-RDG Studies of the Binary Mixture of Water and Essential Oil of <i>Phlomis bruguieri</i>Feride Akman, Azize Demirpolat, Aleksandr S Kazachenko, et al.Pharmaceutics|December 23, 2022
Thrombin and Factor Xa Hydrolysis of Chromogenic Substrates in the Presence of Sulfated Derivatives of Galactomannan and Galactoglucomannan Natural GelsNatalia N Drozd, Svetlana A Kuznetsova, Yuriy N Malyar, et al.Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy|June 9, 2024
The molecular structure, vibrational spectra, solvation effect, non-covalent interactions investigations of psilocinUtkirjon Holikulov, Aleksandr S Kazachenko, Noureddine Issaoui, et al.Journal of Molecular Modeling|January 3, 2021
Theoretical and experimental study of guar gum sulfationAleksandr S Kazachenko, Feride Akman, Abir Sagaama, et al.Molecules (Basel, Switzerland)|February 25, 2023
Synthesis, Empirical and Theoretical Investigations on New Histaminium Bis(Trioxonitrate) CompoundMahdi Jmai, Sofian Gatfaoui, Noureddine Issaoui, et al.Pageof 3