Pregled bibliografske jedinice broj: 257381
Graphical Matrices as Sources of Double Invariants for Use in QSPR
Graphical Matrices as Sources of Double Invariants for Use in QSPR // Proceedings of the International conference on computational methods in sciences and engineering 2004 / Simos, George Maroulis E. ; Simos, Theodorre (ur.).
Leiden: Brill, 2004. str. 750-752 (pozvano predavanje, međunarodna recenzija, sažetak, znanstveni)
CROSBI ID: 257381 Za ispravke kontaktirajte CROSBI podršku putem web obrasca
Naslov
Graphical Matrices as Sources of Double Invariants for Use in QSPR
Autori
Nikolić, Sonja ; Miličević, Ante ; Trinajstić, Nenad
Vrsta, podvrsta i kategorija rada
Sažeci sa skupova, sažetak, znanstveni
Izvornik
Proceedings of the International conference on computational methods in sciences and engineering 2004
/ Simos, George Maroulis E. ; Simos, Theodorre - Leiden : Brill, 2004, 750-752
ISBN
9067644188
Skup
The international conference on computational methods in sciences and engineering 2004 : ICCMSE 2004
Mjesto i datum
Atena, Grčka; Vouliagmeni, Grčka; Atika, Grčka, 19.11.2004. - 23.11.2004
Vrsta sudjelovanja
Pozvano predavanje
Vrsta recenzije
Međunarodna recenzija
Ključne riječi
graphical matrices; chemical graph theory; double > invariants; QSPR
Sažetak
Graphical matrices are presented. Their construction via selected sets of subgraphs and the replacement of subgraphs by numbers representing graph invariants are discussed. The last step of the procedure is to apply the method of choice for obtaining the desired double invariant from the graphical matrix in the numerical form. It is also pointed out that many so-called special graph-theoretical matrices from the literature are rooted in the corresponding graphical matrices.
Izvorni jezik
Engleski
Znanstvena područja
Kemija
Napomena
Lecture Series on Computer and Computational Sciences (ISSN 1573-4196)
