Spectroscopic characterization, molecular docking, and in vitro antibacterial activity of 4-(methyl sulfonyl) benzaldehyde: A DFT approach
Rani Mariam Cherian, Vineetha Vinod, Sneha Mariam John, Vrinda Suresh, C. Ravikumar
Topics & Concepts
ChemistrySulfonylDensity functional theoryBenzaldehydeAntibacterial activityComputational chemistryRaman spectroscopyMoleculeBasis setDocking (animal)ADMEStereochemistryIn vitroOrganic chemistryAlkylBiologyNursingBacteriaCatalysisMedicineBiochemistryGeneticsPhysicsOpticsNonlinear Optical Materials ResearchSynthesis and biological activityFree Radicals and Antioxidants