Browsing by Author "Kocakaya, Şafak Özhan"
Now showing items 1-5 of 5
-
Binding affinities of sanggenon derivatives as PTP1B inhibitors; using molecular dynamics and free energy calculations
Kocakaya, Şafak Özhan (Azerbaijan National Academy of Sciences, 2023)Recently, protein tyrosine phosphatase 1B (PTP1B) inhibitors have become the frontier as possible target-ing for anti-cancer and antidiabetic drugs. The contemporary observe represents a pc assisted version to in-vestigate ... -
Docking studies of natural product derived carvacrol type aromatic monoterpenes against COVID-19 and comparison with used synthetic drugs: Potential of carvacryl acetate against SARS-CoV-2 (COVID-19)
Kocakaya, Şafak Özhan; Ertaş, Abdulselam; Yener, İsmail; Arıca, Enes; Dinçel, Demet (Dicle Üniversitesi Fen Bilimleri Enstitüsü, 2023)The COVID-19 pandemic that broken out in 2020 is becoming more worrying for the world. Although there is no 100 % success against COVID-19, certain synthetic drugs are currently used despite various side effects. ... -
Essential oil contents of Hypericum linarioides , H. helianthemoides, and H. lydium with their biological activities: Importance of Hypericum genus in the cosmeceutical and pharmaceutical industries
Akdeniz, Mehmet; Yener, İsmail; Ertaş, Abdülselam; Dincel, Demet; Fırat, Mehmet; Kocakaya, Şafak Özhan; Yigitkan, Serkan; Türkmenoğlu, Fatma Pınar; Aydın, Fırat; Kolak, Ufuk (Springer, 2023)In the literature, more than 3000 studies have been carried out on species in the Hypericum genus in the last ten years, especially for H. perforatum. The importance of Hypericum species in traditional medicine and modern ... -
The molecular modeling of novel inhibitors of protein tyrosine phosphatase 1B based on catechol by MD and MM-GB (PB)/SA calculations
Kocakaya, Şafak Özhan (Korean Chemical Society, 2014)Binding modes of a series of catechol derivatives such as protein tyrosine phosphatase 1B (PTP1B) inhibitors were identified by molecular modeling techniques. Docking, molecular dynamics simulations and free energy calculations ...
