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EURL ECVAM – European Union Reference Laboratory for Alternatives to Animal Testing, Joint Research Centre (Italy)
Ineris - Institut national de l’environnement industriel et des risques (France)
Liverpool John Moores University, Chemoinformatics Research Group (England)
National Institute of Chemistry, Theory Department - Laboratory for Cheminformatics (Slovenia)
Open Notebook Science (USA)
Partnership for the Assessment of Risks from Chemicals
Simulations Plus, Inc. (USA)
University of Belgrade, Department of Pharmaceutical Chemistry, Faculty of Pharmacy (Serbia)
University of Gdansk, Faculty of Chemistry, Laboratory of Environmental Chemometrics (Poland)
University of Insubria, QSAR Research Unit in Environmental Chemistry and Ecotoxicology, (Italy)
University of Tartu, Institute of Chemistry, Molecular Technology (Estonia)
Vilnius University, Institute of Biotechnology (Lithuania)
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Cronin, M.T.D.; Netzeva, T.I.; Dearden, J.C.; Edwards, R.; Worgan, A.D.P. Assessment and Modeling of the Toxicity of Organic Chemicals to Chlorella vulgaris : Development of a Novel Database. Chem. Res. Toxicol. 2004, 17, 545–554.
Published:
Priit Ahte
(
2015-05-28
)
EcoTox
Regression
Bhhatarai, B.; Gramatica, P. Modelling physico-chemical properties of (benzo)triazoles, and screening for environmental partitioning. Water Res. 2011, 45, 3, 1463–1471.
Published:
Geven Piir
(
2014-12-12
)
PhysChem
Regression
Puzyn, T.; Rasulev, B.; Gajewicz, A.; Hu, X.; Dasari, T. P.; Michalkova, A.; Hwang, H.; Toropov, A.; Leszczynska, D.; Leszczynski, J. Using nano-QSAR to predict the cytotoxicity of metal oxide nanoparticles. Nat. Nanotechnol. 2011, 6, 3, 175–178.
Published:
Geven Piir
(
2014-10-10
)
Regression
Seward, J.R.; Sinks, G.D.; Schultz, T.W. Reproducibility of toxicity across mode of toxic action in the Tetrahymena population growth impairment assay. Aquat. Toxicol. 2001, 53, 1, 33–47.
Published:
Villu Ruusmann
(
2012-05-23
)
Dataset
Katritzky, A. R.; Kasemets, K.; Slavov, S.; Radzvilovits, M.; Tämm, K.; Karelson, M. Estimating the toxicities of organic chemicals in activated sludge process. Water Res. 2010, 44, 2451–2460.
Published:
Geven Piir
(
2017-05-23
)
EcoTox
Regression
Papa, E.; Pilutti, P.; Gramatica, P. Prediction of PAH mutagenicity in human cells by QSAR classification. SAR and QSAR in Environmental Research 2008, 19, 115–127.
Published:
Geven Piir
(
2016-09-20
)
HumanHealth
Classification
Schultz, T.W.; Cajina-Quezada, M. Structure-toxicity Relationships of Selected Nitrogenous Heterocyclic Compounds II. Dinitrogen Molecules. Arch. Environ. Contam. Toxicol. 1982, 11, 3, 353–361.
Published:
Villu Ruusmann
(
2012-05-23
)
Dataset
Richard, A.M.; Hunter, E.S. Quantitative structure-activity relationships for the developmental toxicity of haloacetic acids in mammalian whole embryo culture. Teratology 1996, 53, 352-360.
Published:
Alfonso T. Garcia-Sosa
(
2015-03-17
)
HumanHealth
Regression
Martin, D.; Maran, U.; Sild, S.; Karelson, M. QSPR Modeling of Solubility of Polyaromatic Hydrocarbons and Fullerene in 1-Octanol and n-Heptane. J. Phys. Chem. B 2007, 111, 33, 9853-9857.
Published:
Geven Piir
(
2014-10-10
)
Regression
Schultz, T.W. Structure-Toxicity Relationships for Benzenes Evaluated with Tetrahymena pyriformis. Chem. Res. Toxicol. 1999, 12, 12, 1262–1267.
Published:
Villu Ruusmann
(
2012-05-23
)
Regression
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