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patRoon: open source software platform for environmental mass spectrometry based non-target screening

integration_instructionsResearch softwarekeyboard_double_arrow_right Software Under curationPublisher:Zenodo
Authors: Helmus, Rick; Specker, Jan Christof; Christine, Gallampois; Schymanski, Emma;

doi: 10.5281/zenodo.19474773

patRoon: open source software platform for environmental mass spectrometry based non-target screening

Abstract

This is a major release with significant new functionality and changes, including support for ion mobility separation (IMS-HRMS), new feature detection and grouping algorithms, enhanced identification confidence estimation and use of sample metadata. Please see the NEWS file for more details and important upgrading notes: https://github.com/rickhelmus/patRoon/blob/master/NEWS.md

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