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Carbon Atoms Speaking Out: How the Geometric Sensitivity of (13)C Chemical Shifts Leads to Understanding the Colour Tuning of Phycocyanobilin in Cph1 and AnPixJ

We present a combined quantum mechanics/molecular mechanics (QM/MM) molecular dynamics–statistical approach for the interpretation of nuclear magnetic resonance (NMR) chemical shift patterns in phycocyanobilin (PCB). These were originally associated with colour tuning upon photoproduct formation in...

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Detalles Bibliográficos
Autores principales: Jähnigen, Sascha, Sebastiani, Daniel
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2020
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7727823/
https://www.ncbi.nlm.nih.gov/pubmed/33255423
http://dx.doi.org/10.3390/molecules25235505