Machine learning for identification of silylated derivatives from mass spectra

MOTIVATION: Compound structure identification is using increasingly more sophisticated computational tools, among which machine learning tools are a recent addition that quickly gains in importance. These tools, of which the method titled Compound Structure Identification:Input Output Kernel Regress...

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Detalles Bibliográficos
Autores principales: Ljoncheva, Milka, Stepišnik, Tomaž, Kosjek, Tina, Džeroski, Sašo
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Springer International Publishing 2022
Materias:
Research
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9476372/
https://www.ncbi.nlm.nih.gov/pubmed/36109826
http://dx.doi.org/10.1186/s13321-022-00636-1

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9476372/
https://www.ncbi.nlm.nih.gov/pubmed/36109826
http://dx.doi.org/10.1186/s13321-022-00636-1

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