Theoretical Examination on the Chiral Separation Mechanism of Ibuprofen on Cellulose Tris(4-methylbenzoate)

The mechanism of separating the small chiral drug molecules on large soft polymers is essential in pharmaceutical science. As a case study, the differentiation mechanism of ibuprofen, (<i>R</i>,<i>S</i>)-2-(4-isobutylphenyl)propanoic acid, with cellulose tris(4-methylbenzoate...

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Bibliographic Details

Published in:	Molecules
Main Authors:	Xiao Huang, Yuuichi Orimoto, Yuriko Aoki
Format:	Article
Language:	English
Published:	MDPI AG 2025-08-01
Subjects:	elongation method molecular docking cellulose tris(4-methylbenzoate) ibuprofen complexation energy interactions
Online Access:	https://www.mdpi.com/1420-3049/30/17/3503