Multimolecular polyhedra and QSPR

DOI10.1007/S10910-014-0351-ZzbMATH Open1296.92239OpenAlexW1980963421WikidataQ62511095 ScholiaQ62511095MaRDI QIDQ460944FDOQ460944

Authors: R. Carbó-Dorca 

Publication date: 9 October 2014

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

Full work available at URL: https://doi.org/10.1007/s10910-014-0351-z

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zbMATH Keywords

density functionsMP origin shiftsmultimolecular polyhedraQSPR operatorsquantum MPquantum object setsquantum QSPRtagged sets

Mathematics Subject Classification ID

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

Cites Work

• Mathematical aspects of the LCAO MO first order density function. V: Centroid shifting of MO shape functions basis set, properties and applications
• Shells, point cloud huts, generalized scalar products, cosines and similarity tensor representations in vector semispaces
• Centroid origin shift of quantum object sets and molecular point clouds description and element comparisons
• Variational principle, Hohenberg-Kohn theorem, and density function origin shifts

Cited In (15)

• Title not available (Why is that?)
• A quantum similarity discussion about Einstein-Podolsky-Rosen (EPR) paradox in Gaussian enfolded spaces
• A study on the centroid vector of a polyhedron
• QSPR modelling of molar volume of alkanes using the ZEP topological index
• Universal transformation and non-linear connection between experimental and calculated property vectors in QSPR
• Centroid origin shift of quantum object sets and molecular point clouds description and element comparisons
• \(N\)-dimensional Boolean hypercubes and the Goldbach conjecture
• On the nature of the collective quantum mechanical description of molecular atoms and bonds
• Quantum polyhedra, definitions, statistics and the construction of a collective quantum similarity index
• Molecular Geometry and Molecular Graphics: Natta’s Polypropylene and Beyond
• An isometric representation problem in quantum multimolecular polyhedra and similarity
• An isometric representation problem in quantum multimolecular polyhedra and similarity: II: Synisometry
• Least squares estimation of unknown molecular properties and quantum QSPR fundamental equation
• Hypercubes defined on \(n\)-ary sets, the Erdös-Faber-Lovász conjecture on graph coloring, and the description spaces of polypeptides and RNA
• A theorem on the Gram matrix of a polyhedron

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