H6H_hydroxylation_QMMM

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The original dataset source can be reviewed here
Please use this identifier to cite or link to this collection:doi:10.19061/iochem-bd-4-19

This dataset derived results are published in:

Manuscript title: Regioselectivity of hyoscyamine 6β-hydroxylase-catalysed hydroxylation as revealed by high-resolution structural information and QM/MM calculations

DOI: 10.1039/d0dt00302f

View as
    • ROOT
      • LackingHydrogenBond
      • extendedQM

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