Compound identification in GC-MS by simultaneously evaluating mass spectrum and retention index

We report a compound identification method (SimMR), which simultaneously evaluates the mass spectrum similarity and the retention index distance using an empirical mixture score function, for the analysis of GC-MS data. The performance of the developed SimMR method was compared to that of two existi...

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Bibliographic Details
Published in:Analyst
Main Authors: Wei, Xiaoli, Koo, Imhoi, Kim, Seongho, Zhang, Xiang
Format: Artigo
Language:Inglês
Published: 2014
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Article
Online Access:https://ncbi.nlm.nih.gov/pmc/articles/PMC4308046/
https://ncbi.nlm.nih.gov/pubmed/24665464
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1039/c3an02171h
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