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| QSAR Study of Nitrobenzenes＇ Toxicity to Tetrahymena Pyriformis Using Semi-empirical Quantum Chemical Methods | |
| 作者单位： | YAN Xiu-Fen（Institute for Computation in Molecular and Material Science, School of Chemical Engineering,Nanjing University of Science and Technology, Nanjing 210094, China） ; XIAO He-Ming（Institute for Computation in Molecular and Material Science, School of Chemical Engineering,Nanjing University of Science and Technology, Nanjing 210094, China） ; |
| 摘 要： | |
| 关 键 词： | 硝基苯 定量结构活性关系 毒性 化学结构 化学分析方法 |
QSAR Study of Nitrobenzenes' Toxicity to Tetrahymena Pyriformis Using Semi-empirical Quantum Chemical Methods |
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| Authors: | YAN Xiu-Fen XIAO He-Ming |
| Institution: | Institute for Computation in Molecular and Material Science, School of Chemical Engineering,Nanjing University of Science and Technology, Nanjing 210094, China |
| Abstract: | |
| Keywords: | nitrobenzenes toxicity QSAR semi-empirical MO orbital methods Study QSAR Methods Chemical Quantum Tetrahymena Pyriformis effect molecular orbital take action However reduction nitro group route substituent toxicity halogen aromatic ring chemicals |
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