| 卤代苯的拓扑指数及毒性构—效关系 |
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| 引用本文： | 余训民,习英.卤代苯的拓扑指数及毒性构—效关系[J].湖南文理学院学报(自然科学版),1999(3). |
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| 作者姓名： | 余训民 习英 |
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| 作者单位： | 荆州师范学院化学系!荆州434100(余训民)，常德师范学院化学系!常德415000(习英) |
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| 摘 要： | 根据分子拓扑指数理论，提出了表征卤代苯结构的新拓扑指数XIZ和YZ，并用它们研究了卤代苯化合物对生物的毒性，建立了相对应的定量结构—毒性相关方程，研究结果表明：相关性能良好，标准偏差小，为该类化学品的环境危险性评价提供了依据。
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| 关 键 词： | 卤代苯 发光菌 Na~+—K~+—ATP酶 活力 拓扑指数 定量结构—毒性相关 |
Quantitative Molceular Structure-activity Relationship of Topological Index and Toxicity for Halogenated Benzene |
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| Yu Xunmin.Quantitative Molceular Structure-activity Relationship of Topological Index and Toxicity for Halogenated Benzene[J].Journal of Hunan University of Arts and Science:Natural Science Edition,1999(3). |
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| Authors: | Yu Xunmin |
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| Abstract: | Based on molecular connectivity indces, this paper proposed two new topoloical index XIZ and YZ,quantitaive structure-toxicity relationship(QSTRs) equations were established to estimate the light-emitting toxicities and Na+ -K+ adenosine triposphases(ATPase) activities of halogenated benzene. The fitting and predicted toxic data are close to the observed values of halognated benzene. |
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| Keywords: | halogenated benzene light-emitting bacterium Na~+ -K~+ ATPase activity topological index QSTRs |
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