Information content of molecular graph and prediction of gas phase thermal entropy of organic compounds

DOI10.1007/s10910-013-0233-9zbMath1278.92051OpenAlexW2075706705MaRDI QIDQ395292

Chandan Raychaudhury, Debnath Pal

Publication date: 29 January 2014

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

Full work available at URL: https://doi.org/10.1007/s10910-013-0233-9

zbMATH Keywords

information contentregression modelmolecular descriptor

Mathematics Subject Classification ID

Applications of statistics to physics (62P35) Molecular structure (graph-theoretic methods, methods of differential topology, etc.) (92E10)

Related Items

Usefulness of graph vertex complexity and class partial information content in explaining gas phase thermal entropy of chemical compounds

Cites Work

• The Two-Triangle Case of the Acquaintance Graph
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