tag:joss.theoj.org,2005:/papers/tagged/transformation%20productsJournal of Open Source Software2022-03-12T08:34:22ZJournal of Open Source Softwarehttps://joss.theoj.orgtag:joss.theoj.org,2005:Paper/32372022-03-12T08:34:22Z2022-03-14T12:50:40ZpatRoon 2.0: Improved non-target analysis workflows including automated transformation product screeningaccepted2.0.02021-12-03 13:32:29 UTC712022-03-12 08:34:22 UTC720224029RickHelmusInstitute for Biodiversity and Ecosystem Dynamics (IBED), University of Amsterdam, P.O. Box 94240, 1090 GE Amsterdam, The Netherlands.0000-0001-9401-3133Basvan de VeldeInstitute for Biodiversity and Ecosystem Dynamics (IBED), University of Amsterdam, P.O. Box 94240, 1090 GE Amsterdam, The Netherlands., KWR Water Research Institute, Chemical Water Quality and Health, P.O. Box 1072, 3430 BB Nieuwegein, The Netherlands., Division of BioAnalytical Chemistry, Amsterdam Institute of Molecular and Life Sciences (AIMMS), Vrije Universiteit Amsterdam, 1081 HV Amsterdam, The Netherlands.0000-0003-1292-3251AndreaM.BrunnerKWR Water Research Institute, Chemical Water Quality and Health, P.O. Box 1072, 3430 BB Nieuwegein, The Netherlands., TNO, Environmental Modelling, Sensing and Analysis (EMSA), Princetonlaan 8, 3584 CB, Utrecht, The Netherlands.0000-0002-2801-1751ThomasL.ter LaakInstitute for Biodiversity and Ecosystem Dynamics (IBED), University of Amsterdam, P.O. Box 94240, 1090 GE Amsterdam, The Netherlands., KWR Water Research Institute, Chemical Water Quality and Health, P.O. Box 1072, 3430 BB Nieuwegein, The Netherlands.0000-0002-6182-6004AnnemarieP.van WezelInstitute for Biodiversity and Ecosystem Dynamics (IBED), University of Amsterdam, P.O. Box 94240, 1090 GE Amsterdam, The Netherlands.0000-0002-6875-957XEmmaL.SchymanskiLuxembourg Centre for Systems Biomedicine (LCSB), University of Luxembourg, L-4367 Belvaux, Luxembourg.0000-0001-6868-814510.21105/joss.04029https://doi.org/10.5281/zenodo.6337883https://joss.theoj.org/papers/10.21105/joss.04029.pdfR, non-target screening, transformation products, high resolution mass spectrometry