Ultra-fast and accurate electron ionization mass spectrum matching for compound identification with million-scale in-silico library

Spectrum matching is the most common method for compound identification in mass spectrometry (MS). However, some challenges limit its efficiency, including the coverage of spectral libraries, the accuracy, and the speed of matching. In this study, a million-scale in-silico EI-MS library is establish...

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Detalles Bibliográficos
Autores principales: Yang, Qiong, Ji, Hongchao, Xu, Zhenbo, Li, Yiming, Wang, Pingshan, Sun, Jinyu, Fan, Xiaqiong, Zhang, Hailiang, Lu, Hongmei, Zhang, Zhimin
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Nature Publishing Group UK 2023
Materias:
Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10287733/
https://www.ncbi.nlm.nih.gov/pubmed/37349295
http://dx.doi.org/10.1038/s41467-023-39279-7

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