Phenolic compounds of Theobroma cacao L. show potential against dengue RdRp protease enzyme inhibition by In-silico docking, DFT study, MD simulation and MMGBSA calculation.

Autor: Huq, A. K. M. Moyeenul1,2 (AUTHOR), Roney, Miah1,3 (AUTHOR), Dubey, Amit4,5 (AUTHOR), Nasir, Muhammad Hassan6 (AUTHOR), Tufail, Aisha5 (AUTHOR), Aluwi, Mohd Fadhlizil Fasihi Mohd1,3 (AUTHOR), Ishak, Wan Maznah Wan7 (AUTHOR), Islam, Md. Rabiul8 (AUTHOR) robi.ayaan@gmail.com, Tajuddin, Saiful Nizam1,3 (AUTHOR) robi.ayaan@gmail.com
Zdroj: PLoS ONE. 3/14/2024, Vol. 19 Issue 3, p1-20. 20p.
Databáze: Academic Search Ultimate
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