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An enantioselective study of β-cyclodextrin and ionic liquid-β-cyclodextrin towards propranolol enantiomers by molecular dynamic simulations

In this study, the enantioselectivity of beta-cyclodextrin and its derivatives towards propranolol enantiomers are investigated by molecular dynamic (MD) simulations. beta-cyclodextrin (beta-CD) have previously been shown to be able to recognize propranolol (PRP) enantiomers. To improve upon the ena...

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Bibliographic Details
Main Authors:	Ishak, Mohamad Adil Iman, Aun, Tan Tiek, Sidek, Nadiah, Mohamad, Sharifah, Jumbri, Khairulazhar, Manan, Ninie Suhana Abdul
Format:	Article
Published:	Wiley 2024
Subjects:	QD Chemistry
Online Access:	http://eprints.um.edu.my/45596/ https://doi.org/10.1002/jcc.27321
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