Tackling CASMI 2012: Solutions from MetFrag and MetFusion

The task in the critical assessment of small molecule identification (CASMI) contest category 2 was to determine the identification of (initially) unknown compounds for which high-resolution tandem mass spectra were published. We focused on computer-assisted methods that tried to correctly identify...

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Detalles Bibliográficos
Autores principales: Ruttkies, Christoph, Gerlich, Michael, Neumann, Steffen
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2013
Materias:
Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3901291/
https://www.ncbi.nlm.nih.gov/pubmed/24958142
http://dx.doi.org/10.3390/metabo3030623

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3901291/
https://www.ncbi.nlm.nih.gov/pubmed/24958142
http://dx.doi.org/10.3390/metabo3030623

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