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Aslı Eşme

Observed names: A. Esme, A. Eşme, Asli Esme, Asli Eşme, Aslı Esme, Aslı EŞME, Esme, Aslı, Eşme, A., Eşme, Aslı, asli esme
Observed institution: Kocaeli Üniversitesi
ORCID: 0000-0003-2573-306X
Observed ORCIDs: 0000-0003-2573-306X, 0000-0002-8964-0631
OpenAlex ID: A5000888376
Spectroscopic (FT–IR, FT–Raman, UV–Vis) analysis, conformational, HOMO-LUMO, NBO and NLO calculations on monomeric and dimeric structures of 4–pyridazinecarboxylic acid by HF and DFT methods
2017 · A. Eşme, S.G. Sağdınç · Journal of Molecular Structure · 93
Theoretical and vibrational studies of 4,5-diphenyl-2-2 oxazole propionic acid (oxaprozin)
2010 · Seda G. Sagdinc, Aslı Esme · Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy · 80
Molecular structures, spectroscopic (FT–IR, NMR, UV) studies, NBO analysis and NLO properties for tautomeric forms of 1,3-dimethyl-5-(phenylazo)-6-aminouracil by density functional method
2017 · Aslı Eşme, Seda Güneşdoğdu Sağdınç · Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy · 68
The vibrational studies and theoretical investigation of structure, electronic and non-linear optical properties of Sudan III [1-{[4-(phenylazo) phenyl]azo}-2-naphthalenol]
2013 · Aslı Esme, Seda Gunesdogdu Sagdinc · Journal of Molecular Structure · 58
Chemical reactivities and molecular docking studies of parthenolide with the main protease of HEP-G2 and SARS-CoV-2
2021 · Abdelhak Ouled Aitouna, ME. Belghiti, et al. · Journal of Molecular Structure · 24
Conformational, spectroscopic (FT-IR, FT-Raman, and UV-Vis), and molecular docking studies of N-(2-hydroxyethyl) succinimide
2019 · A. Eşme, S.G. Sagdinc · Journal of Molecular Structure · 22
Theoretical Studies of Molecular Structures, Infrared Spectra, NBO and NLO Properties of Some Novel 5-arylazo-6-hydroxy-4-phenyl-3-cyano-2-pyridone Dyes
2016 · A. Esme, S.G. Sagdinc · Acta Physica Polonica A · 21
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Divulging the regioselectivity of epoxides in the ring-opening reaction, and potential himachalene derivatives predicted to target the antibacterial activities and SARS-CoV-2 spike protein with docking study
2021 · Abdelhak Ouled Aitouna, M.E. Belghiti, et al. · Journal of Molecular Structure · 20
Divulging the various chemical reactivity of trifluoromethyl-4-vinyl-benzene as well as methyl-4-vinyl-benzene in [3+2] cycloaddition reactions
2020 · Mohammed El Idrissi, Asli Eşme, et al. · Journal of Molecular Graphics and Modelling · 20
Theoretical and spectroscopic studies of a tricyclic antidepressant, imipramine hydrochloride
2018 · S.G. Sagdinc, Caner Azkeskin, et al. · Journal of Molecular Structure · 20
Theoretical study on the relationship between the molecular structure and corrosion inhibition efficiency of long alkyl side chain acetamide and isoxazolidine derivatives
2012 · Yesim S. Kara, Seda G. Sagdinc, et al. · Protection of Metals and Physical Chemistry of Surfaces · 20
Mpro-SARS-CoV-2 Inhibitors and Various Chemical Reactivity of 1-Bromo- and 1-Chloro-4-vinylbenzene in [3 + 2] Cycloaddition Reactions
2021 · Mohammed El Idrissi, Mohamed El Ghozlani, et al. · Organics · 18
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The linear, nonlinear optical properties and quantum chemical parameters of some sudan dyes
2014 · Aslı Eşme, Seda Sağdınç · Kocaeli Üniversitesi - AVESİS · 18
TDOS/PDOS/OPDOS, reduced density gradient (RDG) and molecular docking studies of [3-(3-bromophenyl)-cis-4,5-dihydroisoxazole-4,5-diyl]bis(methylene) diacetate
2022 · Yeşim Saniye KARA, Aslı EŞME, et al. · Balıkesir Üniversitesi Fen Bilimleri Enstitüsü Dergisi · 15
Solvent effects on spectroscopic, electronic, and topological analyses, Hirshfeld surface, ADME, and molecular docking studies on antiviral pyridine carboxamide derivatives
2023 · Aslı Eşme, Dorota Kwiatek, et al. · Journal of Molecular Liquids · 11
Experimental and theoretical studies on Sudan Red G [1-(2-methoxyphenylazo)-2-naphthol] and its Cu(II) coordination compound
2014 · Aslı Esme, Seda G. Sagdinc, et al. · Journal of Molecular Structure · 11
Molecular Docking, Regio, Chemo and Stereoselectivity Study of the [3 + 2] Cycloaddition Reaction Between Pyridazi-3-one and Nitrilimine
2023 · Fatima Asserne, Zineb Ouahdi, et al. · Chemistry Africa · 9
Structural, spectral characterization, and topological study of (E)-5-(diethylamino)-2-((3,5-dinitrophenylimino)methyl)phenol
2022 · Aslı Eşme · Structural Chemistry · 9
Synthesis of 4-(4-ethyl-phenyl)-3-(4-methyl-phenyl)-1,2,4-oxadiazol-5(4H)-one and 4-(4-ethyl-phenyl)-3-(4-methyl-phenyl)-1,2,4-oxadiazole-5(4H)-thione and solvent effects on their infrared spectra in organic solvents
2021 · Yesim S. Kara, Mustafa Ünsal, et al. · Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy · 8
Synthesis of some ribonucleosides derivatives and molecular docking analysis against variant corona virus omicrone
2023 · Driss Ouzebla, Najia Ourhriss, et al. · Current Chemistry Letters · 7
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Quantum chemical calculations on the geometrical, conformational, spectroscopic (FTIR, FT-Raman) analysis and NLO activity of milrinone [5-cyano-2-methyl-(3,4'-bipyridin)-6(1h)-one] by using hartree-fock and density functional methods
2017 · Aslı Eşme · Kocaeli Üniversitesi - AVESİS · 7
4-(4-methoxyphenyl)-6-methyl-3-phenyl-4H-1,2,4-oxadiazin-5(6H)-one: Synthesis, crystal structure, Hirshfeld surface analysis, noncovalent, ADMET studies and biological evaluation
2023 · Aslı Eşme, Yesim S. Kara · Journal of Molecular Structure · 6
Theoretical Investigation on the Molecular Structure, Electronic, Spectroscopic Studies and Nonlinear Optical Properties of 5-bromo-1-(2-cyano-pyridin-4-yl)-1H-indazole-3-carboxylic acid diethylamide: a DFT and TD-DFT Study
2019 · A. Eşme · Acta Physica Polonica A · 6
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Efficient One-Pot Synthesis of Indolhydroxy Derivatives Catalyzed by SnCl2, DFT Calculations and Docking Study
2022 · Yassine Hakmaoui, Aslı Eşme, et al. · Chemistry Africa · 5
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Quantum chemical calculations, Hirshfeld surface analysis, and molecular docking studies of antibacterial (E)-N′-((1H-Indol-3-yl)methylene)-4-bromobenzohydrazide
2019 · Aslı Eşme · Spectroscopy Letters · 5
Works count: 52
Citation count: 607
H-index: 14
I10-index: 16
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