定量结构-色谱保留关系在分析化学中的研究进展

The Advance of Quantitative Structure-chromatography Retention Relationship in Analytical Chemistry

定量结构-色谱保留关系能够有效揭示化合物的色谱保留值与其分子微观结构间的关系,分析和预测未知化合物的色谱保留性质及分配机理,备受研究者关注。从预测未知物的色谱保留值、揭示色谱的分配机理以及新型描述符的提取和应用等方面综述了定量结构-色谱保留关系在分析化学中的研究进展,并展望了其应用前景。

The quantitative structure-chromatography retention relationship（QSCRR） can reveal the relationship between the chromatographic retention values of compounds and their structures of molecules effectively,analyze and predict the unknown compounds＇ chromatographic retention properties and distribution mechanism,so researchers have paid much attention on it.The advance and applications of QSCRR in analytical chemistry were reviewed,and the prospect of QSCRR was also forecasted.