Michael J. Strobel

The paper expands a bile acid and steroidal MS/MS spectral library across three repositories, capturing diverse structures and providing a resource for classifying unknown spectra.

The paper introduces mzQC, a standard for representing quality control metrics in mass spectrometry, enabling interoperable and machine-readable QC reporting.

Polyethylene glycol in human biofluids can mark drug exposure rather than contamination; it is oxidized to acid metabolites and appears in 2.3% of public metabolomics files.

This paper integrates MALDI-MS/MS into a bioinformatics platform to enable rapid metabolite annotation and strain prioritization from microbial colonies.

The Everything Bagel feature finder automates metabolomics data processing, achieving comparable or better performance than existing methods with significantly reduced computational time.

IDBac provides a centralized database and platform for bacterial identification via MALDI-TOF MS, enabling spectral comparison and analysis of bacterial isolates.

This paper introduces MT-GEM and STEP to predict discrete structural transformations in metabolites from MS/MS spectra, achieving significant improvements over existing methods.

ModiFinder localizes structural modification sites in small molecules by aligning MS/MS spectra of known and unknown compounds.