Tuğgan Ağar

Quantum computational, spectroscopic investigations on N-(2-((2-chloro-4,5-dicyanophenyl)amino)ethyl)-4-methylbenzenesulfonamide by DFT/TD-DFT with different solvents, molecular docking and drug-likeness researches

Necmi Dege, Halil Gökçe, Onur Erman Doĝan et al. · Colloids and Surfaces A Physicochemical and Engineering Aspects · 2022 · 387 citations

Natural Sciences, Chemistry, Physics +17

Theoretical and experimental approaches of new Schiff bases: efficient synthesis, X-ray structures, DFT, molecular modeling and ADMET studies

Necmi Dege, Muhammad Asam Raza, Onur Erman Doĝan et al. · Journal of the Iranian Chemical Society · 2021 · 90 citations

Natural Sciences, Chemistry, Medicinal Chemistry +12

Synthesis of two new Schiff bases; crystal structure, Hirshfeld surface analysis, density functional theory and molecular docking

Muhammad Asam Raza, Necmi Dege, Onur Erman Doĝan et al. · Journal of Molecular Structure · 2020 · 27 citations

Pharmacy, Chemistry, Medicinal Chemistry +12

Crystal structure, DFT and MEP study of (<i>E</i>)-2-{[(3-chlorophenyl)imino]methyl}-6-methylphenol

H. Saraçoğlu, Onur Erman Doĝan, Tuğgan Ağar et al. · Acta Crystallographica Section E Crystallographic Communications · 2020 · 15 citations · Full text

Natural Sciences, Chemistry, Physics +17