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Physicochemical Prediction of Metabolite Fragmentation in Tandem Mass Spectrometry
Current bottleneck of comprehensive non-target metabolite identification is insufficient spectral library. Many research groups have tried to build a theoretical product ion spectral library independent of measurement condition or settings, but mechanisms of metabolite fragmentation are not fully cl...
Autores principales: | , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
The Mass Spectrometry Society of Japan
2018
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Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6002374/ https://www.ncbi.nlm.nih.gov/pubmed/29922568 http://dx.doi.org/10.5702/massspectrometry.A0066 |