Molecular Networking
uma importante ferramenta computacional para o processo de identificação metabólica a partir de dados de Espectrometria de Massas de alta resolução
Keywords:
Ferramenta Computacional, Alta Resolução, Espectometria de Massas, Identificação MetabólicaAbstract
Metabolite characterization through High Resolution Mass Spectrometry has been widely used nowadays. This technique uses the fragmentation profile of some ion to identify it, however, the identification process to mass fragmentation spectra needs to be compared to the literature and database specific for mass spectrometry, prolonging the time required to identify substances. Molecular Networking is a computational tool, which makes possible to compare many mass fragmentation spectra among them and to databases simultaneously, reducing the time for analysing of the mass fragmentation spectra and speeding up the metabolites identification process.
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