Browsing Department of Applied Science by Subject "Adsorption mechanism"

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Improved anti-inflammatory and anticancer properties of celecoxib loaded zinc oxide and magnesium oxide nanoclusters: A molecular docking and density functional theory simulation

Sun, Nabo; Javed Ansari, Mohammad; Ng Kay Lup, Andrew; Javan, Masoud; Soltani, Alireza; Reza Khandoozi, Seyed; Arian Nia, Ali; Tavassoli, Samaneh; Rahman, Md Lutfor; Sani Sarjadi, Mohd; M. Sarkar, Shaheen; Su, Chia-Hung; Chinh Nguyen, Hoang (Elsevier, 2021-11-15)

Present study offers great prospects for the adsorption of anti-inflammatory celecoxib molecule (CXB) over the surface of zinc oxide (Zn12O12) and magnesium oxide (Mg12O12) nanoclusters in several environments by performing ...