Search results
Results: 72
Number of items: 72
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van Herwerden, D., & Samanipour, S. (2023). Dataset for: RPLC chemical space prediction [Data set]. Figshare. https://doi.org/10.6084/m9.figshare.22587262
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van Herwerden, D., & Samanipour, S. (2023). Dataset: Cumulative neutral loss model for fragment detection in HRMS data [Data set]. Figshare. https://doi.org/10.6084/m9.figshare.22004417.v3
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Dewapriya, P., Nilsson, S., Gorji, S. G., O'Brien, J. W., Bräunig, J., Ramos, M. J. G., Donaldson, E., Samanipour, S., Martin, J. W., Martine, J. F. M., Kaserzon, S. L., & Thomas, K. V. (2023, May 8). Novel Per- and Polyfluoroalkyl Substances Discovered in Cattle Exposed to AFFF-Impacted Groundwater [Data set]. Zenodo. https://doi.org/10.5281/zenodo.7905643
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Alonso, L. L., Slagboom, J., Casewell, N. R., Samanipour, S., & Kool, J. (2023). Metabolome-Based Classification of Snake Venoms by Bioinformatic Tools. Toxins, 15(2), Article 161. https://doi.org/10.3390/toxins15020161 -
Schulze, B., Heffernan, A. L., Samanipour, S., Gomez Ramos, M. J., Veal, C., Thomas, K. V., & Kaserzon, S. L. (2023). Is Nontarget Analysis Ready for Regulatory Application? Influence of Peak-Picking Algorithms on Data Analysis. Analytical Chemistry, 95(50), 18361-18369. https://doi.org/10.1021/acs.analchem.3c03003 -
van Herwerden, D., O'Brien, J. W., Lege, S., Pirok, B. W. J., Thomas, K. V., & Samanipour, S. (2023). Cumulative Neutral Loss Model for Fragment Deconvolution in Electrospray Ionization High-Resolution Mass Spectrometry Data. Analytical Chemistry, 95(33), 12247-12255. https://doi.org/10.1021/acs.analchem.3c00896 -
Hulleman, T., Turkina, V., O'Brien, J. W., Chojnacka, A., Thomas, K. V., & Samanipour, S. (2023). Critical Assessment of the Chemical Space Covered by LC-HRMS Non-Targeted Analysis. Environmental Science and Technology, 57(38), 14101-14492. https://doi.org/10.1021/acs.est.3c03606 -
Hollender, J., Schymanski, E. L., Ahrens, L., Alygizakis, N., Béen, F., Bijlsma, L., Brunner, A. M., Celma, A., Fildier, A., Fu, Q., Gago-Ferrero, P., Gil-Solsona, R., Haglund, P., Hansen, M., Kaserzon, S., Kruve, A., Lamoree, M., Margoum, C., Meijer, J., ... Krauss, M. (2023). NORMAN guidance on suspect and non-target screening in environmental monitoring. Environmental Sciences Europe, 35, Article 75. https://doi.org/10.1186/s12302-023-00779-4 -
Boelrijk, J., van Herwerden, D., Ensing, B., Forré, P., & Samanipour, S. (2023). Predicting RP-LC retention indices of structurally unknown chemicals from mass spectrometry data. Journal of Cheminformatics, 15(1), Article 28. https://doi.org/10.1186/s13321-023-00699-8 -
Dewapriya, P., Nilsson, S., Ghorbani Gorji, S., O'Brien, J. W., Bräunig, J., Gómez Ramos, M. J., Donaldson, E., Samanipour, S., Martin, J. W., Mueller, J. F., Kaserzon, S. L., & Thomas, K. V. (2023). Novel Per- and Polyfluoroalkyl Substances Discovered in Cattle Exposed to AFFF-Impacted Groundwater. Environmental Science and Technology, 57(36), 13635-13645. https://doi.org/10.1021/acs.est.3c03852
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