PFAS (per- and polyfluorinated alkyl substances) as EDCs (endocrine-disrupting chemicals) - Identification of compounds with high potential to bind to selected terpenoids NHRs (nuclear hormone receptors).

Autor: Bulawska N; QSAR Lab, Ul. Trzy Lipy 3, Gdańsk, Poland; University of Gdansk, Faculty of Chemistry, Wita Stwosza 63, 80-308, Gdansk, Poland. Electronic address: n.bulawska@qsarlab.com., Sosnowska A; QSAR Lab, Ul. Trzy Lipy 3, Gdańsk, Poland; University of Gdansk, Faculty of Chemistry, Wita Stwosza 63, 80-308, Gdansk, Poland. Electronic address: anita.sosnowska@ug.edu.pl., Kowalska D; QSAR Lab, Ul. Trzy Lipy 3, Gdańsk, Poland. Electronic address: d.kowalska@qsarlab.com., Stępnik M; QSAR Lab, Ul. Trzy Lipy 3, Gdańsk, Poland. Electronic address: m.stepnik@qsarlab.com., Puzyn T; QSAR Lab, Ul. Trzy Lipy 3, Gdańsk, Poland; University of Gdansk, Faculty of Chemistry, Wita Stwosza 63, 80-308, Gdansk, Poland. Electronic address: tomasz.puzyn@ug.edu.pl.

Publikováno v: Chemosphere [Chemosphere] 2024 Dec 20; Vol. 370, pp. 143967. Date of Electronic Publication: 2024 Dec 20.

Environmental impact of PFAS: Filling data gaps using theoretical quantum chemistry and QSPR modeling.

Autor: Mudlaff M; QSAR Lab, Trzy Lipy 3, 80-172 Gdańsk, Poland., Sosnowska A; QSAR Lab, Trzy Lipy 3, 80-172 Gdańsk, Poland; University of Gdansk, Faculty of Chemistry, Wita Stwosza 63, 80-308 Gdansk, Poland. Electronic address: a.sosnowska@qsarlab.com., Gorb L; QSAR Lab, Trzy Lipy 3, 80-172 Gdańsk, Poland; Institute of Molecular Biology and Genetics, National Academy of Sciences of Ukraine, 150 Zabolotnogo str., 03680 Kyiv, Ukraine., Bulawska N; QSAR Lab, Trzy Lipy 3, 80-172 Gdańsk, Poland; University of Gdansk, Faculty of Chemistry, Wita Stwosza 63, 80-308 Gdansk, Poland., Jagiello K; QSAR Lab, Trzy Lipy 3, 80-172 Gdańsk, Poland; University of Gdansk, Faculty of Chemistry, Wita Stwosza 63, 80-308 Gdansk, Poland., Puzyn T; QSAR Lab, Trzy Lipy 3, 80-172 Gdańsk, Poland; University of Gdansk, Faculty of Chemistry, Wita Stwosza 63, 80-308 Gdansk, Poland. Electronic address: tomasz.puzyn@ug.edu.pl.

Publikováno v: Environment international [Environ Int] 2024 Mar; Vol. 185, pp. 108568. Date of Electronic Publication: 2024 Mar 09.

Expanding the applicability domain of QSPRs for predicting water solubility and vapor pressure of PFAS.

Autor: Sosnowska A; QSAR Lab, Trzy Lipy 3, 80-172, Gdańsk, Poland. Electronic address: a.sosnowska@qsarlab.com., Mudlaff M; QSAR Lab, Trzy Lipy 3, 80-172, Gdańsk, Poland., Gorb L; QSAR Lab, Trzy Lipy 3, 80-172, Gdańsk, Poland; Institute of Molecular Biology and Genetics, National Academy of Sciences of Ukraine, 150 Zabolotnogo Str., 03680, Kyiv, Ukraine., Bulawska N; QSAR Lab, Trzy Lipy 3, 80-172, Gdańsk, Poland., Zdybel S; QSAR Lab, Trzy Lipy 3, 80-172, Gdańsk, Poland., Bakker M; National Institute for Public Health and the Environment (RIVM), Bilthoven, the Netherlands., Peijnenburg W; National Institute for Public Health and the Environment (RIVM), Bilthoven, the Netherlands; Institute of Environmental Sciences (CML), Leiden University, RA Leiden, 2300, the Netherlands., Puzyn T; QSAR Lab, Trzy Lipy 3, 80-172, Gdańsk, Poland; University of Gdansk, Faculty of Chemistry, Wita Stwosza 63, 80-308, Gdansk, Poland. Electronic address: t.puzyn@ug.edu.pl.

Publikováno v: Chemosphere [Chemosphere] 2023 Nov; Vol. 340, pp. 139965. Date of Electronic Publication: 2023 Aug 24.

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.

Autor: Kowalska D; QSAR Lab Ltd., Trzy Lipy 3, 80-172 Gdansk, Poland., Sosnowska A; QSAR Lab Ltd., Trzy Lipy 3, 80-172 Gdansk, Poland., Bulawska N; QSAR Lab Ltd., Trzy Lipy 3, 80-172 Gdansk, Poland., Stępnik M; QSAR Lab Ltd., Trzy Lipy 3, 80-172 Gdansk, Poland., Besselink H; BioDetection Systems B.V., Science Park 406, 1098 XH Amsterdam, The Netherlands., Behnisch P; BioDetection Systems B.V., Science Park 406, 1098 XH Amsterdam, The Netherlands., Puzyn T; QSAR Lab Ltd., Trzy Lipy 3, 80-172 Gdansk, Poland.; Faculty of Chemistry, University of Gdansk, Wita Stwosza 63, 80-308 Gdansk, Poland.

Publikováno v: Molecules (Basel, Switzerland) [Molecules] 2023 Jan 04; Vol. 28 (2). Date of Electronic Publication: 2023 Jan 04.

Per- and Polyfluoroalkyl Substances (PFAS) as Emerging Obesogens: Mechanisms, Epidemiological Evidence, and Regulatory Challenges.

Autor: Lewis, Niya^1,2 (AUTHOR) niya.lewis@sus.edu, Abdulkadir, Abubakar¹ (AUTHOR) abubakar.abdulkadi@sus.edu, Kandel, Shila¹ (AUTHOR) shila.kandel@sus.edu, Rosby, Raphyel¹ (AUTHOR) raphyel_rosby@subr.edu, Hossain, Ekhtear¹ (AUTHOR) md.hossain@subr.edu

Publikováno v: Physiologia. Dec2024, Vol. 4 Issue 4, p517-567. 51p.