477 results on '"Schymanski, Emma L"'
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2. Grouping strategies for assessing and managing persistent and mobile substances
3. InChI isotopologue and isotopomer specifications
4. Dopamine‑iron homeostasis interaction rescues mitochondrial fitness in Parkinson's disease
5. Open access repository-scale propagated nearest neighbor suspect spectral library for untargeted metabolomics
6. NORMAN guidance on suspect and non-target screening in environmental monitoring
7. Non-target screening of surface water samples to identify exposome-related pollutants: a case study from Luxembourg
8. High-throughput Saccharomyces cerevisiae cultivation method for credentialing-based untargeted metabolomics
9. Harmonized quality assurance/quality control provisions to assess completeness and robustness of MS1 data preprocessing for LC-HRMS-based suspect screening and non-targeted analysis
10. Joint structural annotation of small molecules using liquid chromatography retention order and tandem mass spectrometry data
11. Studying the Parkinson’s disease metabolome and exposome in biological samples through different analytical and cheminformatics approaches: a pilot study
12. Water science must be Open Science
13. Towards a harmonized identification scoring system in LC-HRMS/MS based non-target screening (NTS) of emerging contaminants
14. Expanding the Use of Spectral Libraries in Proteomics
15. The NORMAN Suspect List Exchange (NORMAN-SLE): facilitating European and worldwide collaboration on suspect screening in high resolution mass spectrometry
16. Paths to Cheminformatics: Q&A with Norberto Sánchez-Cruz and Emma Schymanski
17. An algorithm to classify homologous series within compound datasets
18. Discovering pesticides and their TPs in Luxembourg waters using open cheminformatics approaches
19. Critical Assessment of Small Molecule Identification 2016: automated methods
20. Should Transformation Products Change the Way We Manage Chemicals?
21. Grouping strategies for assessing and managing persistent and mobile substances
22. Beyond Target Chemicals: Updating the NORMAN Prioritisation Scheme to Support the EU Chemical Strategy with Semi-quantitative Suspect/Non-target Screening Data
23. Quantification Approaches in Non-Target LC/ESI/HRMS Analysis: An Interlaboratory Comparison
24. Adopting Mechanistic Molecular Biology Approaches in Exposome Research for Causal Understanding
25. Adopting Mechanistic Molecular Biology Approaches in Exposome Research for Causal Understanding
26. Adopting Mechanistic Molecular Biology Approaches in Exposome Research for Causal Understanding
27. CLN3 deficiency leads to neurological and metabolic perturbations during early development
28. Dopamine-iron homeostasis interaction rescues mitochondrial fitness in Parkinson's disease
29. InChI Isotopologue and Isotopomer Specifications
30. Empowering large chemical knowledge bases for exposomics: PubChemLite meets MetFrag
31. Retrospective non-target analysis to support regulatory water monitoring: from masses of interest to recommendations via in silico workflows
32. FAIR chemical structures in the Journal of Cheminformatics
33. patRoon: open source software platform for environmental mass spectrometry based non-target screening
34. Retention projection enables accurate calculation of liquid chromatographic retention times across labs and methods
35. Recent analytical methods for risk assessment of emerging contaminants in ecosystems
36. Contributors
37. Dark matter in host-microbiome metabolomics: Tackling the unknowns–A review
38. Per- and Polyfluoroalkyl Substances (PFAS) in PubChem: 7 Million and Growing
39. ELIXIR and Toxicology: a community in development
40. ShinyTPs: Curating Transformation Products from Text Mining Results
41. Historical Exposomics: A Manifesto
42. Can Small Molecules Provide Clues on Disease Progression in Cerebrospinal Fluid from Mild Cognitive Impairment and Alzheimer’s Disease Patients?
43. The NORMAN Association and the European Partnership for Chemicals Risk Assessment (PARC): let’s cooperate!
44. A European proposal for quality control and quality assurance of tandem mass spectral libraries
45. The 'cleanventory': Identifying the Chemical Structures of Persistent and Mobile Substances on Global Trade Markets
46. Open and FAIR transformation product data for improved suspect/non-target screening: REFTPs in the NORMAN-SLE, PubChem and patRoon
47. Non-target LC-HRMS to Study the Exposome of Mild Cognitive Impairment and Alzheimer's Disease on Cerebrospinal Fluid
48. Performance of combined fragmentation and retention prediction for the identification of organic micropollutants by LC-HRMS
49. Avoiding the Next Silent Spring: Our Chemical Past, Present, and Future
50. Similarity of High-Resolution Tandem Mass Spectrometry Spectra of Structurally Related Micropollutants and Transformation Products
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