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Deep Learning-Based Method for Compound Identification in NMR Spectra of Mixtures

Nuclear magnetic resonance (NMR) spectroscopy is highly unbiased and reproducible, which provides us a powerful tool to analyze mixtures consisting of small molecules. However, the compound identification in NMR spectra of mixtures is highly challenging because of chemical shift variations of the sa...

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Detalles Bibliográficos
Autores principales:	Wei, Weiwei, Liao, Yuxuan, Wang, Yufei, Wang, Shaoqi, Du, Wen, Lu, Hongmei, Kong, Bo, Yang, Huawu, Zhang, Zhimin
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	MDPI 2022
Materias:	Article
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9227391/ https://www.ncbi.nlm.nih.gov/pubmed/35744782 http://dx.doi.org/10.3390/molecules27123653

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