A framework for automated structure elucidation from routine NMR spectra

Methods to automate structure elucidation that can be applied broadly across chemical structure space have the potential to greatly accelerate chemical discovery. NMR spectroscopy is the most widely used and arguably the most powerful method for elucidating structures of organic molecules. Here we i...

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Detalles Bibliográficos
Autores principales: Huang, Zhaorui, Chen, Michael S., Woroch, Cristian P., Markland, Thomas E., Kanan, Matthew W.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: The Royal Society of Chemistry 2021
Materias:
Chemistry
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8635205/
https://www.ncbi.nlm.nih.gov/pubmed/34976353
http://dx.doi.org/10.1039/d1sc04105c

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8635205/
https://www.ncbi.nlm.nih.gov/pubmed/34976353
http://dx.doi.org/10.1039/d1sc04105c

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