Concepedia

Synthesis, FT-IR and NMR Characterization, Antibacterial and Antioxidant Activities, and DNA Docking Analysis of a New Vanillin-Derived imine Compound

Sefa Çeli̇k, Funda Özkök, Ayşen E. Özel, Sevim Akyüz

Journal of Molecular Structure · 2021 · 31 citations · 47 references

Concepts

PharmacyChemistryMedicinal ChemistryDrug DiscoveryOrganic ChemistryStructure-activity RelationshipsChemical Space ExplorationMolecular DockingNatural Product Drug DiscoveryNatural Product-based Drug DesignStructure-activity Relationship AnalysisAntibiotic DiscoveryDocking-based Drug DesignMedicinal Chemistry ApplicationsMolecular Docking Analysis

References

47

Density-functional thermochemistry. III. The role of exact exchange

Axel D. Becke · The Journal of Chemical Physics · 1993 · 102.8K citations

Natural Sciences, Chemistry, Physics +13

AutoDock Vina: Improving the speed and accuracy of docking with a new scoring function, efficient optimization, and multithreading

Oleg Trott, Arthur J. Olson · Journal of Computational Chemistry · 2009 · 37.1K citations · Full text

Pharmacy, Chemistry, Medicinal Chemistry +17

Antioxidant Determinations by the Use of a Stable Free Radical

Marsden S. Blois · Nature · 1958 · 12.8K citations

Life Sciences, Biochemistry, Analytical Chemistry +12

Optimization of parameters for semiempirical methods I. Method

James J. P. Stewart · Journal of Computational Chemistry · 1989 · 7.6K citations

Natural Sciences, Materials Science, Computational Mechanics +4

Optimization of parameters for semiempirical methods II. Applications

James J. P. Stewart · Journal of Computational Chemistry · 1989 · 3.7K citations

Natural Sciences, Chemistry, Computational Chemistry +9