Molecular docking, drug-likeness and DFT study of some modified tetrahydrocurcumins as potential anticancer agents

Molecular docking, drug-likeness and DFT study of some modified tetrahydrocurcumins as potential anticancer agents

The present study utilized molecular docking and density functional theory (DFT) approaches, and ADMET (absorption, distribution, metabolism, excretion, and toxicity) properties to investigate the binding interactions, reactivity, stability, and drug-likeness of curcumin (1), tetrahydrocurcumin (2),...

Full description

Bibliographic Details
Main Authors: Ahmed Mahal, Marwan Al-Janabi, Volkan Eyüpoğlu, Anas Alkhouri, Samir Chtita, Mustafa M. Kadhim, Ahmad J. Obaidullah, Jawaher M. Alotaibi, Xiaoyi Wei, Mohammad Rizki Fadhil Pratama
Format: Article
Language:English
Published: Elsevier 2024-01-01
Series:Saudi Pharmaceutical Journal
Subjects:
Tetrahydrocurcumin
Docking
DFT
ADMET
Anticancer
Online Access:http://www.sciencedirect.com/science/article/pii/S1319016423003845

Internet

http://www.sciencedirect.com/science/article/pii/S1319016423003845

Similar Items