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SAR and QSAR in Environmental Research Volume 10, 1999 - Issue 1
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Original Articles

A Noncongeneric Model for Predicting Toxicity of Organic Molecules to Vibrio Fischeri

J. Devillers CTIS, 3 Chemin de la Gravière, 69140, Rillieux La Pape, France
&
D. Domine CTIS, 3 Chemin de la Gravière, 69140, Rillieux La Pape, France; SANOFI Recherche Montpellier, C.A.O./OR314, 371 rue du Professeur Blayac, 34184, Montpellier CEDEX 04, France
Pages 61-70 | Received 29 Sep 1998, Accepted 20 Oct 1998, Published online: 05 Oct 2006

Citations (21)

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Read on this site (10)

Robert D Combes. (2011) Challenges for computational structure–activity modelling for predicting chemical toxicity: future improvements?. Expert Opinion on Drug Metabolism & Toxicology 7:9, pages 1129-1140.
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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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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. Chezeau & E. Thybaud. (2002) PLS-QSAR of the adult and developmental toxicity of chemicals to Hydra attenuata. SAR and QSAR in Environmental Research 13:7-8, pages 705-712.
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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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J. Devillers. (2001) A General QSAR Model for Predicting the Acute Toxicity of Pesticides to Lepomis Macrochirus . SAR and QSAR in Environmental Research 11:5-6, pages 397-417.
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J. Devillers. (2000) Nonlinear Modeling of the Percutaneous Absorption of Polycyclic Aromatic Hydrocarbons. Polycyclic Aromatic Compounds 18:2, pages 231-241.
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M.T. D. Cronin, G.S. Bowers, G.D. Sinks & T.W. Schultz. (2000) Structure-Toxicity Relationships for Aliphatic Compounds Encompassing a Variety of Mechanisms of Toxic Action to Vibrio fischeri . SAR and QSAR in Environmental Research 11:3-4, pages 301-312.
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J. Devillers & J. Flatin. (2000) A General QSAR Model for Predicting the Acute Toxicity of Pesticides to Oncorhynchus mykiss . SAR and QSAR in Environmental Research 11:1, pages 25-43.
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Articles from other publishers (11)

James Devillers. 2014. In Silico Bees. In Silico Bees 135 152 .
Altaf Hussain Pandith & Nasarul Islam. (2013) Comparative assessment of QSTR models based on density functional, hartree-fock, AM1, and PM3 methods for acute toxicity of aliphatic compounds toward Vibrio fischeri . International Journal of Quantum Chemistry 113:6, pages 830-839.
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James Devillers, Pascal Pandard, Eric Thybaud & Anne Merle. 2009. Ecotoxicology Modeling. Ecotoxicology Modeling 85 115 .
James Devillers. 2009. Ecotoxicology Modeling. Ecotoxicology Modeling 1 28 .
James Devillers. 2009. Artificial Neural Networks. Artificial Neural Networks 59 77 .
Andrey Toropov, Pablo Duchowicz & Eduardo Castro. (2003) Structure–Toxicity Relationships for Aliphatic Compounds Based on Correlation Weighting of Local Graph Invariants. International Journal of Molecular Sciences 4:5, pages 272-283.
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Klaus L. E. Kaiser. (2003) Neural networks for effect prediction in environmental and health issues using large datasets. QSAR & Combinatorial Science 22:2, pages 185-190.
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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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Gilles Klopman & Scott E. Stuart. (2009) Multiple computer‐automated structure evaluation study of aquatic toxicity. III. Vibrio fischeri . Environmental Toxicology and Chemistry 22:3, pages 466-472.
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J. Gálvez, J.V. de Julián-Ortiz & R. García-Domenech. (2001) General topological patterns of known drugs. Journal of Molecular Graphics and Modelling 20:1, pages 84-94.
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