Comparative study on structural sensitivity of eigenvalue–based molecular descriptors
Izudin Redžepović, Boris Furtula
Topics & Concepts
ResolventMolecular descriptorMathematicsGraph energySensitivity (control systems)Eigenvalues and eigenvectorsGraphWiener indexTopological indexCombinatoricsEnergy (signal processing)Topology (electrical circuits)ChemistryQuantitative structure–activity relationshipStereochemistryLine graphPure mathematicsStatisticsGraph powerPhysicsQuantum mechanicsEngineeringElectronic engineeringComputational Drug Discovery MethodsGraph theory and applicationsFree Radicals and Antioxidants