Usually quantum chemical calculation is an important way to get structural parameters of specific molecules in study of the structure-activity relationship of organic pollutants.
在有机污染物的结构活性关系研究中，量子化学计算是获得分子结构参数的重要途径。
In this paper, their structural modification and structure-activity relationship are reviewed in order to give some clues for the further research.
本文综述了近年来该类药物结构修饰和构效关系的研究进展，为进一步进行新药研究提供线索。
In the paper, the structural modification and structure-activity relationship of these two types of antibacterials are reviewed in order to give some references for the further research.
本文综述了这两类抗菌剂近年来结构修饰及构效关系的研究进展，为进一步的新药研究提供参考。
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