Quantum chemical computation and spectroscopic investigation on antiviral drug Acyclovir:-In-silico and in-vitro analysis
S. V. D. Nisha, I. Hubert Joe
Topics & Concepts
ChemistryNatural bond orbitalDensity functional theoryComputational chemistryHOMO/LUMOMoleculeHyperpolarizabilityIntramolecular forceStereochemistryOrganic chemistryPolarizabilityNonlinear Optical Materials ResearchCrystallography and molecular interactionsProtein Interaction Studies and Fluorescence Analysis