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Retrospective non-target analysis to support regulatory water monitoring: from masses of interest to recommendations via in silico workflows ArchiMer
Lai, Adelene; Singh, Randolph; Kovalova, Lubomira; Jaeggi, Oliver; Kondić, Todor; Schymanski, Emma L..
Background Applying non-target analysis (NTA) in regulatory environmental monitoring remains challenging—instead of having exploratory questions, regulators usually already have specific questions related to environmental protection aims. Additionally, data analysis can seem overwhelming because of the large data volumes and many steps required. This work aimed to establish an open in silico workflow to identify environmental chemical unknowns via retrospective NTA within the scope of a pre-existing Swiss environmental monitoring campaign focusing on industrial chemicals. The research question addressed immediate regulatory priorities: identify pollutants with industrial point sources occurring at the highest intensities over two time points. Samples from...
Tipo: Text Palavras-chave: Non-target analysis; Suspect screening; Retrospective; Wastewater; Micropollutants; Cheminformatics; Identification; Monitoring; Regulation.
Ano: 2021 URL: https://archimer.ifremer.fr/doc/00689/80141/83195.pdf
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