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Environmental impact of PFAS: Filling data gaps using theoretical quantum chemistry and QSPR modeling.
Environ Int. 2024 Mar;185:108568. doi: 10.1016/j.envint.2024.108568. Epub 2024 Mar 9.
Environ Int. 2024.
PMID: 38493737
Free article.
Expanding the applicability domain of QSPRs for predicting water solubility and vapor pressure of PFAS.
Sosnowska A, Mudlaff M, Gorb L, Bulawska N, Zdybel S, Bakker M, Peijnenburg W, Puzyn T.
Sosnowska A, et al. Among authors: bulawska n.
Chemosphere. 2023 Nov;340:139965. doi: 10.1016/j.chemosphere.2023.139965. Epub 2023 Aug 24.
Chemosphere. 2023.
PMID: 37633602
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How the Structure of Per- and Polyfluoroalkyl Substances (PFAS) Influences Their Binding Potency to the Peroxisome Proliferator-Activated and Thyroid Hormone Receptors-An In Silico Screening Study.
Kowalska D, Sosnowska A, Bulawska N, Stępnik M, Besselink H, Behnisch P, Puzyn T.
Kowalska D, et al. Among authors: bulawska n.
Molecules. 2023 Jan 4;28(2):479. doi: 10.3390/molecules28020479.
Molecules. 2023.
PMID: 36677537
Free PMC article.
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Multivariate assessment of anticancer oleanane triterpenoids lipophilicity.
Pastewska M, Bednarczyk-Cwynar B, Kovačević S, Buławska N, Ulenberg S, Georgiev P, Kapica H, Kawczak P, Bączek T, Sawicki W, Ciura K.
Pastewska M, et al. Among authors: bulawska n.
J Chromatogr A. 2021 Oct 25;1656:462552. doi: 10.1016/j.chroma.2021.462552. Epub 2021 Sep 15.
J Chromatogr A. 2021.
PMID: 34571283
Free article.
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