The detour matrix in chemistry

Trinajstić, Nenad; Nikolić, Sonja; Lučić, Bono; Amić, Dragan; Mihalić, Zlatko

doi:10.1021/ci960149n

Pregled bibliografske jedinice broj: 15909

The detour matrix in chemistry

Trinajstić, Nenad; Nikolić, Sonja; Lučić, Bono; Amić, Dragan; Mihalić, Zlatko

The detour matrix in chemistry // Journal of chemical information and computer sciences, 37 (1997), 4; 631-638 doi:10.1021/ci960149n (međunarodna recenzija, članak, znanstveni)

CROSBI ID: 15909 Za ispravke kontaktirajte CROSBI podršku putem web obrasca

Naslov
The detour matrix in chemistry

Autori
Trinajstić, Nenad ; Nikolić, Sonja ; Lučić, Bono ; Amić, Dragan ; Mihalić, Zlatko

Izvornik
Journal of chemical information and computer sciences (0095-2338) 37 (1997), 4; 631-638

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

Ključne riječi
distance matrix ; chemical graphs ; characteristic-polynomials ; index

Sažetak
The detour matrix of a (chemical) graph is defined. The detour matrix is also defined for weighted graphs. A novel method of computing the detour matrix is introduced. Some properties of the detour matrix and the distance matrix are compared. The invariants of the detour matrix (detour polynomial, detour spectrum, and detour index) are discussed, and several methods for computing these quantities are presented. The use of the detour index is analyzed and compared to the application of the Wiener number in the structure-boiling point modeling.

Izvorni jezik
Engleski

Znanstvena područja
Kemija

POVEZANOST RADA

Projekti:
00980606
079301

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

Profili:

Zlatko Mihalić (autor)