Integrated Probabilistic Annotation (IPA): A Bayesian-based annotation method for metabolomic profiles integrating biochemical connections, isotope patterns and adduct relationships - Supplementary Data
DOI10.5281/zenodo.3414903Zenodo3414903MaRDI QIDQ6724395
Dataset published at Zenodo repository.
Maria Vinaixa, Caitlin Greenland-Bews, Rainer Breitling, Simon Rogers, Francesco del Carratore, Katherine A. Hollywood, Eriko Takano, Kamila Schmidt
Publication date: 16 September 2019
Copyright license: Creative Commons Attribution 4.0 International
Supplementary_data_1: data and code for standards analysis and database update Supplementary_data_2.zip: data and code used for the generation of the synthetic experiment Supplementary_data_3.zip: data, code, and results of the E. coli dataset analysis Supplementary_data_4.zip: data, code, and results of the beer dataset analysis Supplementary_data_5.zip: data, code, and results of the comparison with xMSannotator
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