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A. Karayel

Hitit University

Corum

Turkey

SCHOLARLY PAPERS

5

DOWNLOADS

347

TOTAL CITATIONS

0

Scholarly Papers (5)

1.

Revealing of the Effect of Co/Cu(Dsp2/D7-9) Cationic Doping on an Electronic Acceptor Nanocage Surface for the Adsorption of Ca, Va, and Smx Ligands: Dft-D3, Qtaim, Igm-Nci, and Md Analysis

Number of pages: 66 Posted: 12 May 2023
University of Monastir, University of Carthage, King Khalid University, Hitit University, Hitit University, affiliation not provided to SSRN, Benemérita Universidad Autónoma de Puebla (BUAP), affiliation not provided to SSRN, University of Monastir, 8 Mai 1945 – Guelma University, University of Monastir, University of Carthage, University of Monastir and Wuhan Textile University
Downloads 115 (621,896)

Abstract:

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DFT-D3, Nanocages-ligands, Adsorptions sites, Charge transfer, IGM-NCI, QTAIM-ELF.

2.

Determining the Interaction between the Antiviral Drug Molnupiravir and Calf Thymus DsDNA by Using Electrochemical Studies and Molecular Docking Analysis

Number of pages: 18 Posted: 24 Jan 2024
Ankara University - Ankara University Faculty of Pharmacy, Ankara University - Ankara University Faculty of Pharmacy, Hitit University, Ankara University - Ankara University Faculty of Pharmacy and Ankara University
Downloads 99 (704,534)

Abstract:

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Molnupiravir, Interaction, Deoxyribonucleic acid, Electrochemical Biosensor, Binding constant, Molecular docking

3.

Stability, Spectroscopic, Electrochemistry, and QTAIM Analysis of Cu-Zn1On Clusters for Sensing of Glucose: Theoretical and Experimental Insights

Number of pages: 51 Posted: 03 Nov 2022
University of Monastir, Jazan University, University of Monastir, Hitit University, Hitit University, Benemérita Universidad Autónoma de Puebla (BUAP), Benemérita Universidad Autónoma de Puebla (BUAP), University of Monastir, University of Monastir, Université 8 Mai 1945 Guelma and University of Monastir
Downloads 78 (823,616)

Abstract:

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ZnO, MEP, Detection sites, Charge transfer, QTAIM, DFT-D3

4.

Synthesis, Experimental and Quantum Mechanical Investigation of the Crystal Structures of Two Novel Triazolyl-Indole Compounds, Along with the Evaluation of Their Antioxidant Activity

Number of pages: 22 Posted: 22 Oct 2025
Hitit University, Istanbul University, affiliation not provided to SSRN, Istanbul University, Istanbul University and Istanbul University
Downloads 37 (1,277,121)

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crystal structure, Indole, 1, 2, 4-triazole, Antioxidant Activity, DFT, thione-thiol tautomerism

5.

Synthesis, Elucidation of Structures and Molecular Modelling of Ethyl 2-(2/3/4-chlorobenzamido)-4,7-dihydro-5H-spiro[benzo][b]thiophene-6,2’-[1,3]dioxolane]-3-carboxylate Compounds

Number of pages: 26 Posted: 12 Aug 2025
affiliation not provided to SSRN, affiliation not provided to SSRN, affiliation not provided to SSRN and Hitit University
Downloads 18 (1,481,165)

Abstract:

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Organic Synthesis, Benzamide, Structural Characterization, Molecular Modeling, Antimicrobial Activities.