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Bayesian probabilistic assignment of chemical shifts in organic solids

A prerequisite for NMR studies of organic materials is assigning each experimental chemical shift to a set of geometrically equivalent nuclei. Obtaining the assignment experimentally can be challenging and typically requires time-consuming multidimensional correlation experiments. An alternative sol...

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Detalles Bibliográficos
Autores principales:	Cordova, Manuel, Balodis, Martins, Simões de Almeida, Bruno, Ceriotti, Michele, Emsley, Lyndon
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	American Association for the Advancement of Science 2021
Materias:	Physical and Materials Sciences
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8626066/ https://www.ncbi.nlm.nih.gov/pubmed/34826232 http://dx.doi.org/10.1126/sciadv.abk2341

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