Relativistic distance based and bond additive topological descriptors of zeolite RHO materials
Micheal Arockiaraj, Daniel Paul, Sandi Klavžar, Joseph Clement, Sushil Tigga, K. Balasubramanian
Topics & Concepts
ZeoliteQuantitative structure–activity relationshipChemistryHalogenCharacterization (materials science)Topology (electrical circuits)IonGraphMolecular descriptorMetal ions in aqueous solutionComputational chemistryBiological systemChemical physicsNanotechnologyOrganic chemistryTheoretical computer scienceStereochemistryComputer scienceCombinatoricsMathematicsMaterials scienceAlkylCatalysisBiologyGraph theory and applicationsComputational Drug Discovery MethodsZeolite Catalysis and Synthesis