Comparative study on structural sensitivity of eigenvalue-based molecular descriptors

DOI10.1007/S10910-020-01202-6MaRDI QIDQ830841zbMATH OpenOpenAlexWikidataFDO

Authors Izudin Redžepović, B. Furtula

Publication date 10 May 2021

Published in Journal of Mathematical Chemistry (Search for Journal in Brave)

Full work available at URL https://doi.org/10.1007/s10910-020-01202-6

zbMATH Keywords

eigenvaluesEstrada indexmolecular structuregraph energyresolvent energybenzenoid hydrocarbons

Mathematics Subject Classification ID

Molecular structure (graph-theoretic methods, methods of differential topology, etc.) (92E10) Chemical graph theory (05C92)

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• A survey of graph edit distance
• A very short proof for a lower bound for energy of graphs
• Bounds for energy of matrices and energy of graphs
• Graph energy
• Interface theory of benzenoids: basic applications
• On structural dependence of enthalpy of formation of catacondensed benzenoid hydrocarbons
• Relating total \(\pi\)-electron energy of benzenoid hydrocarbons with HOMO and LOMO energies
• Resolvent energy of graphs

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