Molecular modeling investigation of adsorption of Zolinza drug on surfaces of the B12N12 and Al12N12 nanocages
Masoome Sheikhi, Yavar Ahmadi, Sadegh Kaviani, Siyamak Shаhаb
Topics & Concepts
NanocagesChemistryNatural bond orbitalDensity functional theoryAdsorptionTime-dependent density functional theoryComputational chemistryMolecular orbitalCovalent bondHeteroatomPhysical chemistryMoleculeOrganic chemistryRing (chemistry)CatalysisBoron and Carbon Nanomaterials ResearchBoron Compounds in ChemistryFullerene Chemistry and Applications