- Tytuł:
- On knowledge discovery and representations of molecular structures using topological indices
- Autorzy:
-
Alsaadi, Fawaz E.
Bokhary, Syed Ahtsham Ul Haq
Shah, Aqsa
Ali, Usman
Cao, Jinde
Alassafi, Madini Obad
Rehman, Masood Ur
Rahman, Jamshaid Ul - Powiązania:
- https://bibliotekanauki.pl/articles/2031152.pdf
- Data publikacji:
- 2021
- Wydawca:
- Społeczna Akademia Nauk w Łodzi. Polskie Towarzystwo Sieci Neuronowych
- Tematy:
-
graph network
sheet
topological index
cheminformatics
knowledge discovery - Opis:
- The main purpose of a topological index is to encode a chemical structure by a number. A topological index is a graph invariant, which decribes the topology of the graph and remains constant under a graph automorphism. Topological indices play a wide role in the study of QSAR (quantitative structure-activity relationship) and QSPR (quantitative structure-property relationship). Topological indices are implemented to judge the bioactivity of chemical compounds. In this article, we compute the ABC (atom-bond connectivity); ABC4 (fourth version of ABC), GA(geometric arithmetic) and GA5(fifth version of GA) indices of some networks sheet. These networks include: octonano window sheet; equilateral triangular tetra sheet; rectangular sheet; and rectangular tetra sheet networks.
- Źródło:
-
Journal of Artificial Intelligence and Soft Computing Research; 2021, 11, 1; 21-32
2083-2567
2449-6499 - Pojawia się w:
- Journal of Artificial Intelligence and Soft Computing Research
- Dostawca treści:
- Biblioteka Nauki
Artykuł