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Investigation of anticancer properties of caffeinated complexes via computational chemistry methods

Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 2018-03, Vol.193, p.147-155

2018

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Investigations of structural, spectral and electronic properties of enrofloxacin and boron complexes via quantum chemical calculation and molecular docking

Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 2019-09, Vol.220, p.117102, Article 117102

2019

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Quantum chemical investigation of levofloxacin-boron complexes: A computational approach

Journal of molecular structure, 2018-04, Vol.1158, p.57-65

2018

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Determination of structural, spectral, electronic and biological properties of tosufloxacin boron complexes and investigation of substituent effect

Journal of molecular structure, 2017-10, Vol.1146, p.191-197

2017

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New anti-viral drugs for the treatment of COVID-19 instead of favipiravir

Journal of biomolecular structure & dynamics, 2021-12, Vol.39 (18), p.7263-7273

2021

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Computational Investigations on IR, UV-VIS and NMR Spectra of Copper(II) Phenanthroline Complexes with DFT Method

Cumhuriyet Science Journal, 2017-12, Vol.38 (4), p.661-673

2017

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Pt-Ni@PC900 Hybrid Derived from Layered-Structure Cd-MOF for Fuel Cell ORR Activity

ACS omega, 2020-02, Vol.5 (5), p.2123-2132

2020

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Research of the substituent effect on non-linear optical properties of bis(difluoroboron)-1,2-bis((1H-pyrrol-2-yl)methylene)hydrazine (BOPHY) derivatives: Molecular simulation analyses

Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 2019-04, Vol.212, p.380-387

Sayin, Koray

2019

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Modelling studies on the investigation of non-linear optical properties of some ExnBox cyclophanes

Cumhuriyet Science Journal, 2020-06, Vol.41 (2), p.344-350

2020

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Structural, spectral, biological and antioxidant analyses of baicalin and ıts vanadium complexes: a dft study

Cumhuriyet Science Journal, 2020-03, Vol.41 (1), p.11-21

2020

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Crystal structure, Hirshfeld surface analysis and theoretical calculations of an oxalato-bridged copper(II) complex: μ-oxalato-bis[(2,2’-bipyridine) hydrate copper(II) nitrate]

Journal of the Iranian Chemical Society, 2020-03, Vol.17 (3), p.671-685

2020

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Crystal structure, Hirshfeld surface analysis, computational and antifungal studies of dihydropyrimidines on the basis of salicylaldehyde derivatives

Journal of the Iranian Chemical Society, 2023-01, Vol.20 (1), p.109-123

2023

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Corrigendum to “Research of the substituent effect on non-linear optical properties of bis(difluoroboron)-1,2-bis((1H-pyrrol-2-yl)methylene) hydrazine (BOPHY) derivatives: Molecular Simulation Analyses” [Spectrochim. Acta A Mol. Biomol. Spectrosc. 212 (2019) 380–387]

Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 2019-04, Vol.213, p.397-397

Sayin, Koray

2019

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Revealing the new structure of B8N8 nanocage and comparison of hydrogen storage capacity

Chemical physics, 2022-07, Vol.559, p.111540, Article 111540

2022

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Evaluation of structural, spectral characterization and in vitro cytotoxic activity studies of some polycyclic aromatic compounds

Arabian journal of chemistry, 2020-06, Vol.13 (6), p.5593-5604

2020

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Crystal Structure, Hirshfeld Surface Analysis, In-Silico and Antimycotic Investigations of Methyl 6-methyl-4-(4-nitrophenyl)-2-oxo-1,2-dihydropyrimidine-5-carboxylate

Crystals (Basel), 2023-01, Vol.13 (1), p.52

2023

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Investigation of structural and biological properties of N-heterocyclic carbene silver(I) and palladium(II) complexes

Journal of coordination chemistry, 2018-10, Vol.71 (20), p.3292-3303

Sayin, Koray

2018

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Enhanced Method for the Synthesis and Comprehensive Characterization of 1-(4-Phenylquinolin-2-yl)propan-1-one

ACS omega, 2023-11, Vol.8 (46), p.43573-43585

2023

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Quantum chemical calculations on sparfloxacin and boron complexes

Chemical physics letters, 2019-10, Vol.733, p.136677, Article 136677

2019

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Investigations over optical properties of boron complexes of benzothiazolines

Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 2019-02, Vol.208, p.48-56

2019

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Experimental and theoretical investigation of corrosion inhibition effect of two piperazine-based ligands on carbon steel in acidic media

Colloids and surfaces. A, Physicochemical and engineering aspects, 2022-05, Vol.641, p.128538, Article 128538

2022

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Anti-corrosion behavior of 2-((3-(2-morpholino ethylamino) -N3-((pyridine-2-yl)methyl)propylimino)methyl)pyridine and its reduced form on Carbon Steel in Hydrochloric Acid solution: Experimental and theoretical studies

Thin solid films, 2022-01, Vol.741, p.139036, Article 139036

2022

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Structural, Electronic, ADME and p450 Analyses of Boron Containing Compounds against Omicron Variant (B.1.1.529) in SARS-CoV-2

Cumhuriyet Science Journal, 2023-03, Vol.44 (1), p.72-80

2023

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Investigation of structural, electronic properties and docking calculations of some boron complexes with norfloxacin: A computational research

Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 2018-09, Vol.202, p.276-283

2018

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The investigation of corrosion inhibition efficiency on some benzaldehyde thiosemicarbazones and their thiole tautomers: Computational study

Journal of the Taiwan Institute of Chemical Engineers, 2015-03, Vol.48, p.95-102

2015

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Investigation of anticancer properties of caffeinated complexes via computational chemistry methods

Investigations of structural, spectral and electronic properties of enrofloxacin and boron complexes via quantum chemical calculation and molecular docking

Quantum chemical investigation of levofloxacin-boron complexes: A computational approach

Determination of structural, spectral, electronic and biological properties of tosufloxacin boron complexes and investigation of substituent effect

New anti-viral drugs for the treatment of COVID-19 instead of favipiravir

Computational Investigations on IR, UV-VIS and NMR Spectra of Copper(II) Phenanthroline Complexes with DFT Method

Pt-Ni@PC900 Hybrid Derived from Layered-Structure Cd-MOF for Fuel Cell ORR Activity

Research of the substituent effect on non-linear optical properties of bis(difluoroboron)-1,2-bis((1H-pyrrol-2-yl)methylene)hydrazine (BOPHY) derivatives: Molecular simulation analyses

Modelling studies on the investigation of non-linear optical properties of some ExnBox cyclophanes

Structural, spectral, biological and antioxidant analyses of baicalin and ıts vanadium complexes: a dft study

Crystal structure, Hirshfeld surface analysis and theoretical calculations of an oxalato-bridged copper(II) complex: μ-oxalato-bis[(2,2’-bipyridine) hydrate copper(II) nitrate]

Crystal structure, Hirshfeld surface analysis, computational and antifungal studies of dihydropyrimidines on the basis of salicylaldehyde derivatives

Corrigendum to “Research of the substituent effect on non-linear optical properties of bis(difluoroboron)-1,2-bis((1H-pyrrol-2-yl)methylene) hydrazine (BOPHY) derivatives: Molecular Simulation Analyses” [Spectrochim. Acta A Mol. Biomol. Spectrosc. 212 (2019) 380–387]

Revealing the new structure of B8N8 nanocage and comparison of hydrogen storage capacity

Evaluation of structural, spectral characterization and in vitro cytotoxic activity studies of some polycyclic aromatic compounds

Crystal Structure, Hirshfeld Surface Analysis, In-Silico and Antimycotic Investigations of Methyl 6-methyl-4-(4-nitrophenyl)-2-oxo-1,2-dihydropyrimidine-5-carboxylate

Investigation of structural and biological properties of N-heterocyclic carbene silver(I) and palladium(II) complexes

Enhanced Method for the Synthesis and Comprehensive Characterization of 1-(4-Phenylquinolin-2-yl)propan-1-one

Quantum chemical calculations on sparfloxacin and boron complexes

Investigations over optical properties of boron complexes of benzothiazolines

Experimental and theoretical investigation of corrosion inhibition effect of two piperazine-based ligands on carbon steel in acidic media

Anti-corrosion behavior of 2-((3-(2-morpholino ethylamino) -N3-((pyridine-2-yl)methyl)propylimino)methyl)pyridine and its reduced form on Carbon Steel in Hydrochloric Acid solution: Experimental and theoretical studies

Structural, Electronic, ADME and p450 Analyses of Boron Containing Compounds against Omicron Variant (B.1.1.529) in SARS-CoV-2

Investigation of structural, electronic properties and docking calculations of some boron complexes with norfloxacin: A computational research

The investigation of corrosion inhibition efficiency on some benzaldehyde thiosemicarbazones and their thiole tautomers: Computational study

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