Fragment shape variation index for periodicity deficiency and gradual changes of internal coordinates along linear polymers

DOI10.1007/S10910-011-9939-8MaRDI QIDQ427451zbMATH OpenOpenAlexFDO

Authors Eva Simon, Paul G. Mezey

Publication date 13 June 2012

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

Full work available at URL https://doi.org/10.1007/s10910-011-9939-8

zbMATH Keywords

common structural detail variationsdeficient periodicityfragment shape variation index for linear polymersfragment similarityholographic electron density theoremmolecular fragmentationmolecular similarity

Mathematics Subject Classification ID

Statistical mechanics of polymers (82D60) Molecular structure (graph-theoretic methods, methods of differential topology, etc.) (92E10)

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Cites work

• Molecular fragment shape variation index for functional groups and the holographic properties of electron density

Cited in

(1)

• Molecular fragment shape variation index applied to intramolecular interaction studies

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