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Inclusion complexation of chloroquine with α and β-cyclodextrin: Theoretical insights from the new B97-3c composite method

Ibtissem Meriem Assaba, Seyfeddine Rahali, Youghourta Belhocine, Hamza Allal

2020Journal of Molecular Structure24 citationsDOI

Topics & Concepts

ChemistryCyclodextrinvan der Waals forceIntermolecular forceHydrogen bondNatural bond orbitalChloroquineComputational chemistryInclusion compoundStereochemistryCrystallographyDensity functional theoryMoleculeOrganic chemistryBiologyImmunologyMalariaDrug Solubulity and Delivery SystemsAnalytical Chemistry and ChromatographyProtein Interaction Studies and Fluorescence Analysis
Inclusion complexation of chloroquine with α and β-cyclodextrin: Theoretical insights from the new B97-3c composite method | Litcius