An analysis of the autocorrelation descriptor for molecules

DOI10.1023/A:1023247831238zbMATH Open1018.92037OpenAlexW71749367MaRDI QIDQ1397282FDOQ1397282

Authors: Boris Hollas 

Publication date: 27 July 2003

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

Full work available at URL: https://doi.org/10.1023/a:1023247831238

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zbMATH Keywords

correlationrandom graphsmolecular descriptor

Mathematics Subject Classification ID

Applications of graph theory (05C90) Random graphs (graph-theoretic aspects) (05C80) Molecular structure (graph-theoretic methods, methods of differential topology, etc.) (92E10)

Cited In (6)

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• An analysis of the redundancy of graph invariants used in chemoinformatics
• Statistical properties of spectra of chloronaphthalenes
• DRAGON software: an easy approach to molecular descriptor calculations

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