化学计量学在我国的发展

Initial Study on the Way of Chemometrics into our Country

评述了化学计量学在我国近年来的发展,包括多元校正与分辨、稳健方法、化学模式识别、化学定量构效关系、分子模拟与优化、化学专家系统与数据库等主要分支,其中特别对近年来得到飞速发展的新技术如高维数据解析方法、人工神经网络、小波变换给出了较详细的介绍。

This paper narrates and comments the way of Chemometrics into our country recent years, the main branches such as many Yuan adjustments and the resolution, the robust methods, chemistry pattern recognition, chemistry quota construction effect reahlons, the molecular simulation and optimized, chemistry expert system and the database included. Particular mention the new technical like high dimension according to the analysis method, artificial neural networks, wavelet transformation has been highly developed in recent years.