Discovering pesticides and their TPs in Luxembourg waters using open cheminformatics approaches

Autor: Krier, Jessy, Singh, Randolph R., Kondić, Todor, Lai, Adelene, Diderich, Philippe, Zhang, Jian, Thiessen, Paul A., Bolton, Evan E., Schymanski, Emma L.

Publikováno v: In Environment International January 2022 158

ShinyTPs: Curating transformation products from text mining results

Autor: Palm, Emma, Krier, Jessy, Schymanski, Emma

Poster presented at the ZeroPM workshop:Achieving Zero Pollution of Persistent and Mobile Substances: Prevention through Chemical Alternatives, Policy Action and Market Transition

Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::1fc2d4f725561fcb270dadf46c00cf0f
https://doi.org/10.5281/zenodo.7681693

The NORMAN Suspect List Exchange (NORMAN-SLE): facilitating European and worldwide collaboration on suspect screening in high resolution mass spectrometry

Autor: Mohammed Taha, Hiba, Aalizadeh, Reza, Alygizakis, Nikiforos, Antignac, Jean-Philippe, Arp, Hans Peter H, Bade, Richard, Baker, Nancy, Belova, Lidia, Bijlsma, Lubertus, Bolton, Evan E, Brack, Werner, Celma, Alberto, Chen, Wen-Ling, Cheng, Tiejun, Chirsir, Parviel, Čirka, Ľuboš, D'Agostino, Lisa A, Djoumbou Feunang, Yannick, Dulio, Valeria, Fischer, Stellan, Gago-Ferrero, Pablo, Galani, Aikaterini, Geueke, Birgit, Głowacka, Natalia, Glüge, Juliane, Groh, Ksenia, Grosse, Sylvia, Haglund, Peter, Hakkinen, Pertti J, Hale, Sarah E, Hernandez, Felix, Janssen, Elisabeth M-L, Jonkers, Tim, Kiefer, Karin, Kirchner, Michal, Koschorreck, Jan, Krauss, Martin, Krier, Jessy, Lamoree, Marja H, Letzel, Marion, Letzel, Thomas, Li, Qingliang, Little, James, Liu, Yanna, Lunderberg, David M, Martin, Jonathan W, McEachran, Andrew D, McLean, John A, Meier, Christiane, Meijer, Jeroen, Menger, Frank, Merino, Carla, Muncke, Jane, Muschket, Matthias, Neumann, Michael, Neveu, Vanessa, Ng, Kelsey, Oberacher, Herbert, O'Brien, Jake, Oswald, Peter, Oswaldova, Martina, Picache, Jaqueline A, Postigo, Cristina, Ramirez, Noelia, Reemtsma, Thorsten, Renaud, Justin, Rostkowski, Pawel, Rüdel, Heinz, Salek, Reza M, Samanipour, Saer, Scheringer, Martin, Schliebner, Ivo, Schulz, Wolfgang, Schulze, Tobias, Sengl, Manfred, Shoemaker, Benjamin A, Sims, Kerry, Singer, Heinz, Singh, Randolph R, Sumarah, Mark, Thiessen, Paul A, Thomas, Kevin V, Torres, Sonia, Trier, Xenia, van Wezel, Annemarie P, Vermeulen, Roel C H, Vlaanderen, Jelle J, von der Ohe, Peter C, Wang, Zhanyun, Williams, Antony J, Willighagen, Egon L, Wishart, David S, Zhang, Jian, Thomaidis, Nikolaos S, Hollender, Juliane, Slobodnik, Jaroslav, Schymanski, Emma L, IRAS OH Epidemiology Chemical Agents

Publikováno v: Environmental Sciences Europe, 34(1):104, 1-26. Springer Verlag
Mohammed Taha, H, Aalizadeh, R, Alygizakis, N, Antignac, J P, Arp, H P H, Bade, R, Baker, N, Belova, L, Bijlsma, L, Bolton, E E, Brack, W, Celma, A, Chen, W L, Cheng, T, Chirsir, P, Čirka, Ľ, D’Agostino, L A, Djoumbou Feunang, Y, Dulio, V, Fischer, S, Gago-Ferrero, P, Galani, A, Geueke, B, Głowacka, N, Glüge, J, Groh, K, Grosse, S, Haglund, P, Hakkinen, P J, Hale, S E, Hernandez, F, Janssen, E M L, Jonkers, T, Kiefer, K, Kirchner, M, Koschorreck, J, Krauss, M, Krier, J, Lamoree, M H, Letzel, M, Letzel, T, Li, Q, Little, J, Liu, Y, Lunderberg, D M, Martin, J W, McEachran, A D, McLean, J A, Meier, C, Meijer, J, Menger, F, Merino, C, Muncke, J, Muschket, M, Neumann, M, Neveu, V, Ng, K, Oberacher, H, O’Brien, J, Oswald, P, Oswaldova, M, Picache, J A, Postigo, C, Ramirez, N, Reemtsma, T, Renaud, J, Rostkowski, P, Rüdel, H, Salek, R M, Samanipour, S, Scheringer, M, Schliebner, I, Schulz, W, Schulze, T, Sengl, M, Shoemaker, B A, Sims, K, Singer, H, Singh, R R, Sumarah, M, Thiessen, P A, Thomas, K V, Torres, S, Trier, X, van Wezel, A P, Vermeulen, R C H, Vlaanderen, J J, von der Ohe, P C, Wang, Z, Williams, A J, Willighagen, E L, Wishart, D S, Zhang, J, Thomaidis, N S, Hollender, J, Slobodnik, J & Schymanski, E L 2022, ' The NORMAN Suspect List Exchange (NORMAN-SLE) : facilitating European and worldwide collaboration on suspect screening in high resolution mass spectrometry ', Environmental Sciences Europe, vol. 34, 104 . https://doi.org/10.1186/s12302-022-00680-6
Digital.CSIC. Repositorio Institucional del CSIC
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Environmental Sciences Europe, 34:104. Springer Verlag
Environmental Sciences Europe
Environmental Sciences Europe (2190-4707) (Springer Science and Business Media LLC), 2022-12, Vol. 34, N. 1, P. 104 (26p.)
Environmental Sciences Europe, 34 (1)
Mohammed Taha, H, Aalizadeh, R, Alygizakis, N, Antignac, J P, Arp, H P H, Bade, R, Baker, N, Belova, L, Bijlsma, L, Bolton, E E, Brack, W, Celma, A, Chen, W L, Cheng, T, Chirsir, P, Čirka, Ľ, D’Agostino, L A, Djoumbou Feunang, Y, Dulio, V, Fischer, S, Gago-Ferrero, P, Galani, A, Geueke, B, Głowacka, N, Glüge, J, Groh, K, Grosse, S, Haglund, P, Hakkinen, P J, Hale, S E, Hernandez, F, Janssen, E M L, Jonkers, T, Kiefer, K, Kirchner, M, Koschorreck, J, Krauss, M, Krier, J, Lamoree, M H, Letzel, M, Letzel, T, Li, Q, Little, J, Liu, Y, Lunderberg, D M, Martin, J W, McEachran, A D, McLean, J A, Meier, C, Meijer, J, Menger, F, Merino, C, Muncke, J, Muschket, M, Neumann, M, Neveu, V, Ng, K, Oberacher, H, O’Brien, J, Oswald, P, Oswaldova, M, Picache, J A, Postigo, C, Ramirez, N, Reemtsma, T, Renaud, J, Rostkowski, P, Rüdel, H, Salek, R M, Samanipour, S, Scheringer, M, Schliebner, I, Schulz, W, Schulze, T, Sengl, M, Shoemaker, B A, Sims, K, Singer, H, Singh, R R, Sumarah, M, Thiessen, P A, Thomas, K V, Torres, S, Trier, X, van Wezel, A P, Vermeulen, R C H, Vlaanderen, J J, von der Ohe, P C, Wang, Z, Williams, A J, Willighagen, E L, Wishart, D S, Zhang, J, Thomaidis, N S, Hollender, J, Slobodnik, J & Schymanski, E L 2022, ' The NORMAN Suspect List Exchange (NORMAN-SLE) : facilitating European and worldwide collaboration on suspect screening in high resolution mass spectrometry ', Environmental Sciences Europe, vol. 34, no. 1, 104, pp. 1-26 . https://doi.org/10.1186/s12302-022-00680-6
Environmental Sciences Europe, 34(1):104. Springer Verlag
Environmental Sciences Europe, 34(1). Springer Verlag
Environmental sciences Europe

Background: The NORMAN Association (https:// www. norman-​netwo rk. com/) initiated the NORMAN Suspect List Exchange (NORMAN-SLE; https:// www. norman-​netwo rk. com/ nds/ SLE/) in 2015, following the NORMAN collaborative trial on non-target scre

Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::cc19d175cac682140500682194522d47
https://api.elsevier.com/content/abstract/scopus_id/85140599341

Discovering Pesticides, Pharmaceuticals & TPs in Luxembourg Waters using Open Cheminformatics Approaches

Autor: Krier, Jessy, Singh, Randolph R., Kondic, Todor, Lai, Adelene, Diderich, Philippe, Zhang, Jian (Jeff), Thiessen, Paul A., Bolton, Evan E., Schymanski, Emma L.

Invited Keynote Presentation for Metabolomics2021 (virtual), the 17th Annual Conference of the Metabolomics Society. Presenter: Emma Schymanski. Talk scheduled for 24 June 2021 (3 pm CEST).

Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_________::9b06eb6a34b3068738eb4a561f678f95