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SAR and QSAR in Environmental Research Volume 17, 2006 - Issue 2: Computational Methods in Toxicology and Pharmacology Integrating Internet Resources, (CMTPI 2005)–Part 2, Shanghai, China, October 29–November 1, 2005, Guest Editors: B. T. Fan, B. Jiang, J. P. Doucet and J. H. Yao
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Original Articles

QSPRs for the prediction of photodegradation half-life of PCBs in n-hexane

J. F. Niu State Key Laboratory of Water Environment Simulation, School of Environment, Beijing Normal University, Beijing 100875, P. R. ChinaCorrespondence[email protected]
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Z. F. Yang State Key Laboratory of Water Environment Simulation, School of Environment, Beijing Normal University, Beijing 100875, P. R. China
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Z. Y. Shen State Key Laboratory of Water Environment Simulation, School of Environment, Beijing Normal University, Beijing 100875, P. R. China
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L. L. Wang State Key Laboratory of Water Environment Simulation, School of Environment, Beijing Normal University, Beijing 100875, P. R. China
Pages 173-182 | Received 10 Oct 2005, Accepted 06 Jan 2006, Published online: 01 Feb 2007

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M.H. Fatemi & Z. Ghareh Chahi. (2012) QSPR-based estimation of the half-lives for polychlorinated biphenyl congeners. SAR and QSAR in Environmental Research 23:1-2, pages 155-168.
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Articles from other publishers (16)

Jiale He & Zhongyu Wang. 2024. QSAR in Safety Evaluation and Risk Assessment. QSAR in Safety Evaluation and Risk Assessment 373 387 .
Jiale He, Jingwen Chen, Jieqiong Wang, Linke Ge, Feifei Cui & Xi Chen. (2023) Prediction models for photochemical persistence of chemicals in aquatic environments. Chinese Science Bulletin.
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Yitao Lyu, Taobo Huang, Wen Liu & Weiling Sun. (2022) Unveil the quantum chemical descriptors determining direct photodegradation of antibiotics under simulated sunlight: Batch experiments and model development. Journal of Environmental Chemical Engineering 10:3, pages 108086.
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Nasser Jalili-Jahani, Azadeh Fatehi & Ehsan Zeraatkar. (2020) PLS and N-PLS based MIA-QSPR modeling of the photodegradation half-lives for polychlorinated biphenyl congeners. RSC Advances 10:56, pages 33753-33761.
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Shiyao Liao, Xinliang Yu, Jianfang Chen & Xianwei Huang. (2019) Prediction of the half-lives of polychlorinated biphenyls based on the IEF-PCM calculations. Journal of Theoretical and Computational Chemistry 18:07, pages 1950033.
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Xinliang Yu. (2019) Prediction of Depuration Rate Constants for Polychlorinated Biphenyl Congeners. ACS Omega 4:13, pages 15615-15620.
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A. Vijaya Bhaskar Reddy, M. Moniruzzaman & Tejraj M. Aminabhavi. (2019) Polychlorinated biphenyls (PCBs) in the environment: Recent updates on sampling, pretreatment, cleanup technologies and their analysis. Chemical Engineering Journal 358, pages 1186-1207.
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Qing Zhang. (2013) Predictive models on photolysis and photoinduced toxicity of persistent organic chemicals. Frontiers of Environmental Science & Engineering 7:6, pages 803-814.
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Tao Jiang, Hanmin Zhang, Dawen Gao, Feng Dong, Jifeng Gao & Fenglin Yang. (2012) Fouling characteristics of a novel rotating tubular membrane bioreactor. Chemical Engineering and Processing: Process Intensification 62, pages 39-46.
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Hanmin Zhang, Yanjie Ma, Tao Jiang, Guangyi Zhang & Fenglin Yang. (2012) Influence of activated sludge properties on flux behavior in osmosis membrane bioreactor (OMBR). Journal of Membrane Science 390-391, pages 270-276.
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Yueping Bao, Qiuying Huang, Wenlong Wang, Jiangjie Xu, Fan Jiang & Chenghong Feng. (2011) Application of quantum chemical descriptors into quantitative structure-property relationship models for prediction of the photolysis half-life of PCBs in water. Frontiers of Environmental Science & Engineering in China 5:4, pages 505-511.
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Jun Qi, Jia Wei, Changhong Sun & Tao Pan. (2011) A comparative QSPR study on aqueous solubility of polycyclic aromatic hydrocarbons by GA-SVM, GA-RBFNN and GA-PLS. Frontiers of Earth Science.
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Qi Jun, Sun Chang-Hong & Wei Jia. (2010) Comparison of Genetic Algorithm Based Support Vector Machine and Genetic Algorithm Based RBF Neural Network in Quantitative Structure-Property Relationship Models on Aqueous Solubility of Polycyclic Aromatic Hydrocarbons. Procedia Environmental Sciences 2, pages 1429-1437.
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Ying Wang, Jingwen Chen, Fei Li, Hong Qin, Xianliang Qiao & Ce Hao. (2009) Modeling photoinduced toxicity of PAHs based on DFT-calculated descriptors. Chemosphere 76:7, pages 999-1005.
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Xue LI, Lei FANG, Jun HUANG & Gang YU. (2008) Photolysis of mono-through deca-chlorinated biphenyls by ultraviolet irradiation in n-hexane and quantitative structure-property relationship analysis. Journal of Environmental Sciences 20:6, pages 753-759.
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Lorentz Jäntschi, Sorana Bolboaca & Mircea Diudea. (2007) Chromatographic Retention Times of Polychlorinated Biphenyls: from Structural Information to Property Characterization. International Journal of Molecular Sciences 8:11, pages 1125-1157.
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