A graph-theoretic approach to predicting molecular properties

DOI10.1016/0895-7177(90)90235-FMaRDI QIDQ804522zbMATH OpenOpenAlexFDO

Authors Subhash C. Basak, Gerald J. Niemi, Gilman D. Veith

Publication date 1990

Published in Mathematical and Computer Modelling (Search for Journal in Brave)

Full work available at URL https://doi.org/10.1016/0895-7177(90)90235-f

zbMATH Keywords

connectivity indicesgraph invariantsinformation-theoretic indiceslipophilicitySARstructure-activity relationshiptopological indices

Mathematics Subject Classification ID

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

Cites work

• A Mathematical Theory of Communication
• scientific article; zbMATH DE number 3118808 (Why is no real title available?)
• scientific article; zbMATH DE number 3504074 (Why is no real title available?)
• scientific article; zbMATH DE number 3358495 (Why is no real title available?)

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