Szeged-like topological descriptors and CoM-polynomials for graphs of someAlzheimer’s agents
Yazarlar (3)
Doç. Dr. Esra ÖZTÜRK SÖZEN Sinop Üniversitesi, Türkiye
Arş. Gör. Elif ERYAŞAR Sinop Üniversitesi, Türkiye
Doç. Dr. Şükriye ÇAKMAK Sinop Üniversitesi, Türkiye
| Makale Türü | Özgün Makale (SSCI, AHCI, SCI, SCI-Exp dergilerinde yayınlanan tam makale) | ||
| Dergi Adı | Molecular Physics (Q3) | ||
| Dergi ISSN | 0026-8976 Dergi Bilgileri (2024) | ||
| Dergi Tarandığı Indeksler | SCI-Expanded | ||
| Makale Dili | İngilizce | Basım Tarihi | 01-2024 |
| Cilt / Sayı / Sayfa | 122 / 14 / – | DOI | 10.1080/00268976.2024.2305853 |
| Makale Linki | https://doi.org/10.1080/00268976.2024.2305853 | ||
| UAK Araştırma Alanları |
Cebir ve Sayılar Teorisi
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| Özet |
| In this study, we define Szeged-like topological coindices in which formulas are constructed by a complement of a given graph. We introduce two new co-polynomials of two variables, denoted by and briefly, to compute modifications and edge versions of these molecular descriptors. In order to the perform the effect of the topological descriptors, firstly we obtain the graph structures of five novel diamide derivatives which are considered potential agents for Alzheimer’s disease. After completing the computation process of each index from some modifications of the polynomials mentioned above, we correlate the coindices values with the pMIC values of the compounds against three Gram-negative bacteria E. coli, P. aeruginosa, K. pneumoniae, and three Gram-positive bacteria E. faecalis, B. cereus, S. aeurus to predict the bioactivity properties. As a result of the QSAR analysis, we get good … |
| Anahtar Kelimeler |
| 05385 | 05C12 | 05C31 | 05C92 | Alzheimer’s disease | QSAR analysis | SMPe¯ polynomial | SMP¯ polynomial | Szeged-like indices |
BM Sürdürülebilir Kalkınma Amaçları
| Atıf Sayıları | |
| Web of Science | 7 |
| Scopus | 8 |
| Google Scholar | 10 |