Pregled bibliografske jedinice broj: 468440
Computer Generation and Identification of Carcinogenic Bay Regions in Benzenoid Hydrocarbons
Computer Generation and Identification of Carcinogenic Bay Regions in Benzenoid Hydrocarbons // International Journal of Quantum Chemistry, 23 (1983), 2; 713-722 doi:10.1002/qua.560230240 (međunarodna recenzija, članak, znanstveni)
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Naslov
Computer Generation and Identification of Carcinogenic Bay Regions in Benzenoid Hydrocarbons
Autori
Knop, J.V. ; Szymansky, K. ; Jeričević, Željko ; Trinajstić, Nenad
Izvornik
International Journal of Quantum Chemistry (0020-7608) 23
(1983), 2;
713-722
Vrsta, podvrsta i kategorija rada
Radovi u časopisima, članak, znanstveni
Ključne riječi
computer enumeration ; bay regions ; benzenoid hydrocarbons
Sažetak
A computer-oriented algorithm is developed for identification and enumeration of carcinogenic bay regions in benzenoid hydrocarbons.The results are reported for geometrically planar benzenoid systems up to ten fused rings.They fully agree with those obtained in a different way by Balasubramanian et al. The advantage of the proposed method is that we can display all planar benzenoid structures and identify the carcinogenic bays in each of them.
Izvorni jezik
Engleski
Znanstvena područja
Matematika, Kemija, Računarstvo
Citiraj ovu publikaciju:
Časopis indeksira:
- Current Contents Connect (CCC)
- Web of Science Core Collection (WoSCC)
- Science Citation Index Expanded (SCI-EXP)
- SCI-EXP, SSCI i/ili A&HCI
- Scopus
