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Mechanistic study of the biosynthesis of R-phenylcarbinol by acetohydroxyacid synthase enzyme using hybrid quantum mechanics/molecular mechanics simulations

2021

Alvarado, Omar | García-Meseguer, Rafael | Ruiz-Pernía, Jose Javier | Tuñón, Iñaki | Delgado, Eduardo J.


Bibliographic information
Archives of biochemistry and biophysics
Volume 701 Pagination 108807 ISSN 0003-9861
Publisher
Elsevier Inc.
Other Subjects
Lewis bases; R-pac; Acetolactate synthase; Gibbs free energy; Ahas; Mechanism; Quantum mechanics; Molecular dynamics; Qm/mm simulations
Language
English
Type
Text; Journal Article

2024-02-28
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