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“Ask Ernö”: a self-learning tool for assignment and prediction of nuclear magnetic resonance spectra
BACKGROUND: We present “Ask Ernö”, a self-learning system for the automatic analysis of NMR spectra, consisting of integrated chemical shift assignment and prediction tools. The output of the automatic assignment component initializes and improves a database of assigned protons that is used by the c...
Autores principales: | Castillo, Andrés M., Bernal, Andrés, Dieden, Reiner, Patiny, Luc, Wist, Julien |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
Springer International Publishing
2016
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4858875/ https://www.ncbi.nlm.nih.gov/pubmed/27158267 http://dx.doi.org/10.1186/s13321-016-0134-6 |
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