Xavier Domingo-Almenara

METLIN: A Technology Platform for Identifying Knowns and Unknowns

Carlos Guijas, J. Rafael Montenegro-Burke, Xavier Domingo-Almenara et al. · Analytical Chemistry · 2018 · 926 citations · Full text

Engineering, Metabolomic Profiling, Molecular Biology +28

The METLIN small molecule dataset for machine learning-based retention time prediction

Xavier Domingo-Almenara, Carlos Guijas, Elizabeth Billings et al. · Nature Communications · 2019 · 225 citations · Full text

eRah: A Computational Tool Integrating Spectral Deconvolution and Alignment with Quantification and Identification of Metabolites in GC/MS-Based Metabolomics

Xavier Domingo-Almenara, J. Brezmes, María Vinaixa et al. · Analytical Chemistry · 2016 · 133 citations · Full text

XCMS-MRM and METLIN-MRM: a cloud library and public resource for targeted analysis of small molecules

Xavier Domingo-Almenara, J. Rafael Montenegro-Burke, Julijana Ivanišević et al. · Nature Methods · 2018 · 130 citations

Targeted Library, Molecular Recognition, Targeted Analysis +13

Exposome-Scale Investigations Guided by Global Metabolomics, Pathway Analysis, and Cognitive Computing

Benedikt Warth, Scott Spangler, Mingliang Fang et al. · Analytical Chemistry · 2017 · 126 citations

Artificial Intelligence, Exposome-scale Investigations, Metlin Exposome Database +22