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3D-QSAR Research of Triazolopyrimidine Herbicide
Author(s): 
Pages: 50-53
Year: Issue:  2
Journal: JOURNAL OF TIANJIN NORMAL UNIVERSITY(NATURAL SCIENCE EDITION)

Keyword:  三唑嘧啶磺酰胺除草剂3D-QSAR;
Abstract: 三唑嘧啶磺酰胺类除草剂是作用于乙酰乳酸合成酶的一类新型除草剂.本研究利用限制性系统搜索,确定了活性构象,并用比较分子场方法 (COMFA)研究了24个化合物的三维定量构效关系, 建立了具有较强预测能力的3D-QSAR模型.研究结果表明, 影响其药效的主要因素是空间结构.
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