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Pregled bibliografske jedinice broj: 772451

The Distance Matrix in Chemistry

Mihalić, Zlatko; Veljan, Darko; Amić, Dragan; Nikolić, Sonja; Plavšić, Dejan; Trinajstić, Nenad
The Distance Matrix in Chemistry // Journal of mathematical chemistry, 11 (1992), 1; 223-258 doi:10.1007/BF01164206 (međunarodna recenzija, članak, znanstveni)

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Naslov
The Distance Matrix in Chemistry

Autori
Mihalić, Zlatko ; Veljan, Darko ; Amić, Dragan ; Nikolić, Sonja ; Plavšić, Dejan ; Trinajstić, Nenad

Izvornik
Journal of mathematical chemistry (0259-9791) 11 (1992), 1; 223-258

Vrsta, podvrsta i kategorija rada
Radovi u časopisima, članak, znanstveni

Ključne riječi
chemical graphs ; constitutional symmetry ; chromatographic data ; retention indexes

Sažetak
The graph-theoretical (topological) distance matrix and the geometric (topographic) distance matrix and their invariants (polynomials, spectra, determinants and Wiener numbers) are presented. Methods of computing these quantities are discussed. The uses of the distance matrix in both forms and the related invariants in chemistry are surveyed. Special attention is paid to the 2D and 3D Wiener numbers, defined respectively as one half of the sum of entries in the topological distance matrix and the topographic distance matrix. These numbers appear to be very valuable molecular descriptors in the structure-property correlations.

Izvorni jezik
Engleski

Znanstvena područja
Kemija



POVEZANOST RADA

Ustanove:
Prirodoslovno-matematički fakultet, Matematički odjel, Zagreb,
Fakultet agrobiotehničkih znanosti Osijek,
Institut "Ruđer Bošković", Zagreb,
Prirodoslovno-matematički fakultet, Zagreb

Profili:

Avatar Url Dragan Amić (autor)

Avatar Url Sonja Nikolić (autor)

Avatar Url Dejan Plavšić (autor)

Avatar Url Darko Veljan (autor)

Avatar Url Nenad Trinajstić (autor)

Avatar Url Zlatko Mihalić (autor)

Poveznice na cjeloviti tekst rada:

doi link.springer.com

Citiraj ovu publikaciju:

Mihalić, Zlatko; Veljan, Darko; Amić, Dragan; Nikolić, Sonja; Plavšić, Dejan; Trinajstić, Nenad
The Distance Matrix in Chemistry // Journal of mathematical chemistry, 11 (1992), 1; 223-258 doi:10.1007/BF01164206 (međunarodna recenzija, članak, znanstveni)
Mihalić, Z., Veljan, D., Amić, D., Nikolić, S., Plavšić, D. & Trinajstić, N. (1992) The Distance Matrix in Chemistry. Journal of mathematical chemistry, 11 (1), 223-258 doi:10.1007/BF01164206.
@article{article, author = {Mihali\'{c}, Zlatko and Veljan, Darko and Ami\'{c}, Dragan and Nikoli\'{c}, Sonja and Plav\v{s}i\'{c}, Dejan and Trinajsti\'{c}, Nenad}, year = {1992}, pages = {223-258}, DOI = {10.1007/BF01164206}, keywords = {chemical graphs, constitutional symmetry, chromatographic data, retention indexes}, journal = {Journal of mathematical chemistry}, doi = {10.1007/BF01164206}, volume = {11}, number = {1}, issn = {0259-9791}, title = {The Distance Matrix in Chemistry}, keyword = {chemical graphs, constitutional symmetry, chromatographic data, retention indexes} }
@article{article, author = {Mihali\'{c}, Zlatko and Veljan, Darko and Ami\'{c}, Dragan and Nikoli\'{c}, Sonja and Plav\v{s}i\'{c}, Dejan and Trinajsti\'{c}, Nenad}, year = {1992}, pages = {223-258}, DOI = {10.1007/BF01164206}, keywords = {chemical graphs, constitutional symmetry, chromatographic data, retention indexes}, journal = {Journal of mathematical chemistry}, doi = {10.1007/BF01164206}, volume = {11}, number = {1}, issn = {0259-9791}, title = {The Distance Matrix in Chemistry}, keyword = {chemical graphs, constitutional symmetry, chromatographic data, retention indexes} }

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