A graph-theoretic approach to predicting molecular properties

DOI10.1016/0895-7177(90)90235-FzbMath0727.92032OpenAlexW2013842271MaRDI QIDQ804522

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

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

SARgraph invariantstopological indicesconnectivity indicesinformation-theoretic indiceslipophilicitystructure-activity relationship

Mathematics Subject Classification ID

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

Cites Work

• A Mathematical Theory of Communication
• Unnamed Item
• Unnamed Item
• Unnamed Item

This page was built for publication: A graph-theoretic approach to predicting molecular properties