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Molecular Dynamics Simulations of a Conformationally Mobile Peptide-Based Catalyst for Atroposelective Bromination

It is widely accepted that structural rigidity is required to achieve high levels of asymmetric induction in catalytic, enantioselective reactions. This fundamental design principle often does not apply to highly selective catalytic peptides that often exhibit conformational heterogeneity. As a resu...

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Vydáno v:ACS Catal
Hlavní autoři: Yan, Xin Cindy, Metrano, Anthony J., Robertson, Michael J., Abascal, Nadia C., Tirado–Rives, Julian, Miller, Scott J., Jorgensen, William L.
Médium: Artigo
Jazyk:Inglês
Vydáno: 2018
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On-line přístup:https://ncbi.nlm.nih.gov/pmc/articles/PMC6342276/
https://ncbi.nlm.nih.gov/pubmed/30687577
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acscatal.8b03563
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