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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...
Autores principales: | Huang, Zhaorui, Chen, Michael S., Woroch, Cristian P., Markland, Thomas E., Kanan, Matthew W. |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
The Royal Society of Chemistry
2021
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Materias: | |
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 |
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