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柳爱平; 陆爱军; 黄明智; 陈灿; 刘兴平; 刘钊杰; 姚建仁
Source Publication高等学校化学学报
Other AbstractThe quantitative relationship between the structure of oxime-ether compounds containing sulfur(oxygen) and their insecticidal activity against leafhopper was studied by comparative molecular field analysis(CoMFA). The results showed that the contributions of steric and electrostatic fields to the activity were 47.5% and 52.5%, respectively. The coefficient q2 of cross validation and the relation coefficient r2 of non-cross validation for the model established by the study were 0.628 and 0.971, respectively, its F value was 133.840 and the standard deviation was 0.109. These values indicated that the model might have a good predictability. The contour maps of the model will give the basis on the structure modification.
Keyword含硫(氧)肟醚化合物 三维定量构效关系(3d-qsar) 比较分子力场分析(Comfa)
Document Type期刊论文
Recommended Citation
GB/T 7714
柳爱平,陆爱军,黄明智,等. 含硫(氧)肟醚化合物杀虫活性三维定量构效关系研究[J]. 高等学校化学学报,2005(03):464-466.
APA 柳爱平.,陆爱军.,黄明智.,陈灿.,刘兴平.,...&姚建仁.(2005).含硫(氧)肟醚化合物杀虫活性三维定量构效关系研究.高等学校化学学报(03),464-466.
MLA 柳爱平,et al."含硫(氧)肟醚化合物杀虫活性三维定量构效关系研究".高等学校化学学报 .03(2005):464-466.
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