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This is the collection associated with the S121 | EAWAGBBD | Curated Transformation Reactions from Eawag-BBD dataset on the NORMAN Suspect List Exchange (NORMAN-SLE).
A set of hand-curated transformation reactions from the Eawag Biocatalysis/Biodegradation Database (Eawag-BBD), collated and curated by Emma Palm from the Eawag-BBD website. DOI: 10.1093/nar/gkp771
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This is the collection associated with list S66 EAWAGTPS - Parent-Transformation Product Pairs from Eawag on the NORMAN Suspect List Exchange.
https://www.norman-network.com/nds/SLE/
Parent-Transformation Product Pairs of various micropollutants from Eawag: Swiss Federal Institute for Aquatic Science and Technology (https://www.eawag.ch/en/), described in Schollee et al 2017 DOI:10.1007/s13361-017-1797-6 . Dataset DOI: 10.5281/zenodo.3754449
Update 23/04/2020: fixed names, added synonym columns and classification information.
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TwitterThe University of Minnesota Biocatalysis/Biodegradation Database (UM-BBD) contains information on microbial biocatalytic reactions and biodegradation pathways for primarily xenobiotic, chemical compounds. The UM-BBD Pathway Prediction System (PPS) predicts microbial catabolic reactions using substructure searching, a rule-base, and atom-to-atom mapping. The PPS recognizes organic functional groups found in a compound and predicts transformations based on biotransformation rules. These rules are based on reactions found in the UM-BBD database. This collection references those rules.
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This dataset is about: EAWAG Profiling Ion Analyser Data, Lake Rot, Switzerland (ROT20100914).
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The graph shows the citations of ^'s papers published in each year.
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TwitterThe University of Minnesota Biocatalysis/Biodegradation Database (UM-BBD) contains information on microbial biocatalytic reactions and biodegradation pathways for primarily xenobiotic, chemical compounds. The goal of the UM-BBD is to provide information on microbial enzyme-catalyzed reactions that are important for biotechnology. This collection refers to pathway information.
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This is the collection associated with list S7 EAWAGSURF on the NORMAN Suspect List Exchange.
https://www.norman-network.com/?q=suspect-list-exchange
Note this collection does not contain explicit structures.
S7
EAWAGSURF
Eawag Surfactants Suspect List
CompTox EAWAGSURF List
Schymanski et al. 2014. DOI: 10.1021/es4044374
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This is the collection associated with list S7 EAWAGSURF on the NORMAN Suspect List Exchange.
https://www.norman-network.com/nds/SLE/
Updated 21/11/2019 to contain representative explicit structures for species observed in the 2014 study. Note that for some species multiple isomers are possible; only one representative has been added per formula. Structures created using RChemMass (https://github.com/schymane/RChemMass/)
S7: EAWAGSURF: Eawag Surfactants Suspect List
Suspect formulas: CSV, XLSX
CompTox EAWAGSURF List
Schymanski et al. 2014. DOI: 10.1021/es4044374
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TwitterThis dataset was created by Mrithul Samuel
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List of Top Journals of Eawag sorted by citations.
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This MassBank record with Accession MSBNK-Eawag-EQ331601 contains the MS2 mass spectrum of Linoleic acid with the InChIkey OYHQOLUKZRVURQ-HZJYTTRNSA-N.
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List of Top Authors of Eawag sorted by citations.
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This MassBank record with Accession MSBNK-Eawag-EA277059 contains the MS2 mass spectrum of Aspartame with the InChIkey IAOZJIPTCAWIRG-QWRGUYRKSA-N.
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The graph shows the publications of ^ in high impact journals such as Chemical Reviews, Reviews of Modern Physics, etc. The classification of 2/3-star journals is according to the Danish Ministry of Higher Education and Science.
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List of Top Disciplines of Eawag sorted by citations.
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This MassBank record with Accession MSBNK-Eawag-EQ320105 contains the MS2 mass spectrum of Hydrocortisone with the InChIkey JYGXADMDTFJGBT-VWUMJDOOSA-N.
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This is the collection associated with list S82 | EAWAGPMT | PMT Suspect List from Eawag on the NORMAN Suspect List Exchange.
https://www.norman-network.com/nds/SLE/
A PMT suspect screening list containing >1100 entries from Kiefer et al (2021), DOI: 10.1016/j.watres.2021.116994
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This MassBank record with Accession MSBNK-Eawag-EQ320507 contains the MS2 mass spectrum of Minocycline with the InChIkey DYKFCLLONBREIL-KVUCHLLUSA-N.
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This MassBank record with Accession MSBNK-Eawag-EQ324101 contains the MS2 mass spectrum of Resveratrol with the InChIkey LUKBXSAWLPMMSZ-OWOJBTEDSA-N.
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TwitterAttribution 4.0 (CC BY 4.0)https://creativecommons.org/licenses/by/4.0/
License information was derived automatically
This is the collection associated with the S121 | EAWAGBBD | Curated Transformation Reactions from Eawag-BBD dataset on the NORMAN Suspect List Exchange (NORMAN-SLE).
A set of hand-curated transformation reactions from the Eawag Biocatalysis/Biodegradation Database (Eawag-BBD), collated and curated by Emma Palm from the Eawag-BBD website. DOI: 10.1093/nar/gkp771