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化学计量学在一维和二维色谱中的最新应用。

Recent applications of chemometrics in one- and two-dimensional chromatography.

机构信息

Division of Bioanalytical Chemistry, Amsterdam Institute for Molecules, Medicines and Systems, Vrije Universiteit Amsterdam, Amsterdam, The Netherlands.

Centre for Analytical Sciences Amsterdam (CASA), Amsterdam, The Netherlands.

出版信息

J Sep Sci. 2020 May;43(9-10):1678-1727. doi: 10.1002/jssc.202000011. Epub 2020 Mar 19.

Abstract

The proliferation of increasingly more sophisticated analytical separation systems, often incorporating increasingly more powerful detection techniques, such as high-resolution mass spectrometry, causes an urgent need for highly efficient data-analysis and optimization strategies. This is especially true for comprehensive two-dimensional chromatography applied to the separation of very complex samples. In this contribution, the requirement for chemometric tools is explained and the latest developments in approaches for (pre-)processing and analyzing data arising from one- and two-dimensional chromatography systems are reviewed. The final part of this review focuses on the application of chemometrics for method development and optimization.

摘要

日益复杂的分析分离系统的激增,通常结合越来越强大的检测技术,如高分辨率质谱,对高效数据分析和优化策略提出了迫切需求。对于应用于非常复杂样品分离的全二维色谱来说尤其如此。在本贡献中,解释了对化学计量学工具的需求,并回顾了用于(预处理)和分析来自一维和二维色谱系统的数据的最新进展。本综述的最后一部分重点介绍了化学计量学在方法开发和优化中的应用。

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