In vitro antioxidant activity, QSAR, in silico toxicity prediction, molecular docking studies, and molecular dynamics of a series of N-ferrocenylmethylanilines as potent antioxidant agents
Elhafnaoui Lanez, Abdellatif Kedadra, Touhami Lanez, Aicha Adaika, Nadjiba Zegheb, Nadjiba Zegheb
Topics & Concepts
ChemistryQuantitative structure–activity relationshipIn silicoAntioxidantIn vitroDocking (animal)StereochemistryMolecular dynamicsComputational biologyComputational chemistryBiochemistryBiologyMedicineGeneNursingFerrocene Chemistry and ApplicationsComputational Drug Discovery MethodsSynthesis and biological activity