Additional Supporting Information to "Occurrence and Distribution of Pharmaceuticals and their Transformation Products in Luxembourgish Surface Waters" by Singh et al.
Additional Supporting Information to "Occurrence and Distribution of Pharmaceuticals and their Transformation Products in Luxembourgish Surface Waters" by Singh et al. Contains R code, input, and output files for data visualisation/figure generation running MetFrag as described in the Methods section generating a curated Suspect List of TPs mined from PubChem & merged with list in the literature ; https://git-r3lab.uni.lu/adelene.lai/additional_si_luxpharma_singh_et_al/-/tags/zenodo-v1
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| Dokumenttyp: | other |
| Erscheinungsdatum: | 2021 |
| Schlagwörter: | environmental cheminformatics / data visualisation / mass spectrometry / pubchem / transformation products / non-target screening / pharmaceuticals / suspect screening / surface water / cheminformatics / environmental chemistry |
| Sprache: | Englisch |
| Permalink: | https://search.fid-benelux.de/Record/base-26746378 |
| Datenquelle: | BASE; Originalkatalog |
| Powered By: | BASE |
| Link(s) : | https://zenodo.org/record/4745360 |
