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

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 robust theoretical calculations. Density functional theory (DFT), time-depen...

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Main Authors:	Nabo Sun, Mohammad Javed Ansari, Ng, Andrew Kay Lup, Masoud Javan, Alireza Soltani, Seyed Reza Khandoozi, Ali Arian Nia, Samaneh Tavassoli, Md Lutfor Rahman, Mohd Sani Sarjadi, Shaheen M. Sarkar, Su, Chia-Hung, Hoang Chinh Nguyen
Format:	Article
Language:	en en
Published:	Elsevier 2021
Subjects:	RC254-282 Neoplasms. Tumors. Oncology Including cancer and carcinogens
Online Access:	https://eprints.ums.edu.my/id/eprint/32180/4/Improved%20anti-inflammatory%20and%20anticancer%20properties%20of%20celecoxib%20loaded%20zinc%20oxide%20and%20magnesium%20oxide%20nanoclusters_%20A%20molecular%20docking%20and%20density%20functional%20theory%20simulation_ABSTRACT.pdf https://eprints.ums.edu.my/id/eprint/32180/1/Improved%20anti-inflammatory%20and%20anticancer%20properties%20of%20celecoxib%20loaded%20zinc%20oxide%20and%20magnesium%20oxide%20nanoclusters_%20A%20molecular%20docking%20and%20density%20functional%20theory%20simulation.pdf https://eprints.ums.edu.my/id/eprint/32180/ https://www.sciencedirect.com/science/article/pii/S1878535221005839 https://doi.org/10.1016/j.arabjc.2021.103568
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