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GitHub / scannotation / Scannotation_software
Scannotation is an automated and user-friendly suspect screening tool for the rapid pre-annotation of LC-HRMS datasets. This software combines several MS1 chemical predictors: m/z, retention times, isotopic patterns and neutral loss patterns, to score the proximity between features and suspects, thus efficiently prioritizing compounds of interest.
JSON API: https://repos.ecosyste.ms/api/v1/hosts/GitHub/repositories/scannotation%2FScannotation_software
Stars: 3
Forks: 1
Open Issues: 0
License: other
Language:
Repo Size: 275 MB
Dependencies: pending
Created: 12 months ago
Updated: 7 days ago
Last pushed: 7 days ago
Last synced: 7 days ago
Topics: annotations, compound-identification, exposome, hrms, isotopic-patterns, metabolite, neutral-loss, non-targeted-analysis, retention-times, scoring, software, suspect-screening, user-friendly