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SAR and QSAR in Environmental Research Volume 11, 2001 - Issue 5-6
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Original Articles

A General QSAR Model for Predicting the Acute Toxicity of Pesticides to Lepomis Macrochirus

J. Devillers CTIS, 3 Chemin de la Gravière Rillieux La Pape 69140, (France)
Pages 397-417 | Received 05 Jun 2000, Accepted 03 Aug 2000, Published online: 24 Sep 2006

Citations (30)

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M. Vračko, V. Bandelj, P. Barbieri, E. Benfenati, Q. Chaudhry, M. Cronin, J. Devillers, A. Gallegos, G. Gini, P. Gramatica, C. Helma, P. Mazzatorta, D. Neagu, T. Netzeva, M. Pavan, G. Patlewicz, M. Randić, I. Tsakovska & A. Worth. (2006) Validation of counter propagation neural network models for predictive toxicology according to the OECD principles: a case study. SAR and QSAR in Environmental Research 17:3, pages 265-284.
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N. Piclin, M. Pintore, C. Wechman, A. Roncaglioni, E. Benfenati & J. R. Chretien. (2006) Ecotoxicity prediction by adaptive fuzzy partitioning: comparing descriptors computed on 2D and 3D structures. SAR and QSAR in Environmental Research 17:2, pages 225-251.
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J. Devillers. (2005) A new strategy for using supervised artificial neural networks in QSAR. SAR and QSAR in Environmental Research 16:5, pages 433-442.
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J. Devillers. (2004) Linear versus nonlinear QSAR modeling of the toxicity of phenol derivatives to Tetrahymena pyriformis . SAR and QSAR in Environmental Research 15:4, pages 237-249.
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J. Devillers, A. Decourtye, H. Budzinski, M.H. Pham-Delègue, S. Cluzeau & G. Maurin. (2003) Comparative toxicity and hazards of pesticides to Apis and non-Apis bees. A chemometrical study. SAR and QSAR in Environmental Research 14:5-6, pages 389-403.
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J. Devillers. (2001) QSAR Modeling of Large Heterogeneous Sets of Molecules. SAR and QSAR in Environmental Research 12:6, pages 515-528.
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Articles from other publishers (24)

Floriane Larras, Sandrine Charles, Arnaud Chaumot, Céline Pelosi, Morgane Le Gall, Laure Mamy & Rémy Beaudouin. (2022) A critical review of effect modeling for ecological risk assessment of plant protection products. Environmental Science and Pollution Research 29:29, pages 43448-43500.
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Runsheng Song, Dingsheng Li, Alexander Chang, Mengya Tao, Yuwei Qin, Arturo A. Keller & Sangwon Suh. (2021) Accelerating the pace of ecotoxicological assessment using artificial intelligence. Ambio 51:3, pages 598-610.
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Pathan Mohsin Khan, Kunal Roy & Emilio Benfenati. (2019) Chemometric modeling of Daphnia magna toxicity of agrochemicals. Chemosphere 224, pages 470-479.
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Igor I. Baskin. 2018. Computational Toxicology. Computational Toxicology 119 139 .
Mabrouk Hamadache, Abdeltif Amrane, Othmane Benkortbi, Salah Hanini, Latifa Khaouane & Cherif Si Moussa. 2017. Advances in QSAR Modeling. Advances in QSAR Modeling 471 501 .
Jae Hyoun Kim. (2012) Is it Possible to Predict the ADI of Pesticides using the QSAR Approach?. Korean Journal of Environmental Health Sciences 38:6, pages 550-560.
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Flor A. Quintero, Suhani J. Patel, Felipe Muñoz & M. Sam Mannan. (2012) Review of Existing QSAR/QSPR Models Developed for Properties Used in Hazardous Chemicals Classification System. Industrial & Engineering Chemistry Research 51:49, pages 16101-16115.
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Elton Zvinavashe, Albertinka J. Murk & Ivonne M.C.M. Rietjens. (2009) On the number of EINECS compounds that can be covered by (Q)SAR models for acute toxicity. Toxicology Letters 184:1, pages 67-72.
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James Devillers. 2009. Ecotoxicology Modeling. Ecotoxicology Modeling 1 28 .
James Devillers. 2009. Artificial Neural Networks. Artificial Neural Networks 59 77 .
Andrey A. Toropov & Emilio Benfenati. (2007) SMILES as an alternative to the graph in QSAR modelling of bee toxicity. Computational Biology and Chemistry 31:1, pages 57-60.
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Xavier Gironés & Ramon Carbó‐Dorca. (2006) Modelling Toxicity using Molecular Quantum Similarity Measures. QSAR & Combinatorial Science 25:7, pages 579-589.
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Daphne de Roode, Conny Hoekzema, Selinda de Vries-Buitenweg, Beppy van de Waart & Jan van der Hoeven. (2006) QSARs in ecotoxicological risk assessment. Regulatory Toxicology and Pharmacology 45:1, pages 24-35.
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Andrey A. Toropov & Emilio Benfenati. (2006) QSAR models for Daphnia toxicity of pesticides based on combinations of topological parameters of molecular structures. Bioorganic & Medicinal Chemistry 14:8, pages 2779-2788.
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Kunal Roy & Indrani Sanyal. (2006) QSTR with Extended Topochemical Atom Indices. 7. QSAR of Substituted Benzenes to Saccharomyces cerevisiae . QSAR & Combinatorial Science 25:4, pages 359-371.
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Kunal Roy & Gopinath Ghosh. (2005) QSTR with extended topochemical atom (ETA) indices. VI. Acute toxicity of benzene derivatives to tadpoles (Rana japonica). Journal of Molecular Modeling 12:3, pages 306-316.
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Kunal Roy & Gopinath Ghosh. (2004) QSTR with Extended Topochemical Atom Indices. 3. Toxicity of Nitrobenzenes to Tetrahymena pyriformis . QSAR & Combinatorial Science 23:2-3, pages 99-108.
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Marco Pintore, Nadège Piclin, Emilio Benfenati, Giuseppina Gini & Jacques R. Chrétien. (2003) Database mining with adaptive fuzzy partition: Application to the prediction of pesticide toxicity on rats. Environmental Toxicology and Chemistry 22:5, pages 983-991.
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Marco Pintore, Nadège Piclin, Emilio Benfenati, Giuseppina Gini & Jacques R. Chrétien. (2003) Predicting Toxicity against the fathead Minnow by Adaptive Fuzzy Partition. QSAR & Combinatorial Science 22:2, pages 210-219.
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Klaus L.E. Kaiser. (2003) The use of neural networks in QSARs for acute aquatic toxicological endpoints. Journal of Molecular Structure: THEOCHEM 622:1-2, pages 85-95.
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Stefan P Niculescu. (2003) Artificial neural networks and genetic algorithms in QSAR. Journal of Molecular Structure: THEOCHEM 622:1-2, pages 71-83.
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Mark Cronin. 2003. Quantitative Structure-Activity Relationship (QSAR) Models of Mutagens and Carcinogens. Quantitative Structure-Activity Relationship (QSAR) Models of Mutagens and Carcinogens.
James Devillers. 2003. Nature-insprired Methods in Chemometrics: Genetic Algorithms and Artificial Neural Networks. Nature-insprired Methods in Chemometrics: Genetic Algorithms and Artificial Neural Networks 323 339 .
S.M Barlow, J.B Greig, J.W Bridges, A Carere, A.J.M Carpy, C.L Galli, J Kleiner, I Knudsen, H.B.W.M Koëter, L.S Levy, C Madsen, S Mayer, J.-F Narbonne, F Pfannkuch, M.G Prodanchuk, M.R Smith & P Steinberg. (2002) Hazard identification by methods of animal-based toxicology. Food and Chemical Toxicology 40:2-3, pages 145-191.
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