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基于随机搜索过程,用进化遗传算法拟合洛伦兹峰。

Fitting Lorentzian peaks with evolutionary genetic algorithm based on stochastic search procedure.

作者信息

Karakaplan Mustafa

机构信息

Inonu University, Art and Science Faculty, Chemistry Department, 44280-Malatya, Turkey.

出版信息

Anal Chim Acta. 2007 Mar 28;587(2):235-9. doi: 10.1016/j.aca.2007.01.058. Epub 2007 Jan 27.

Abstract

A global search technique for curve fitting based on evolutionary random search was modified and applied for quantifying a combination of Gaussian and Lorentzian peaks. This stochastic search procedures based on randomized operators is a modified Monte Carlo method. The proposed method tested on self obtained several overlapped Lorentzian peaks with random noise, Lennard particles in three dimensions and discrete mathematical functions previously used for optimization in literature. It was found to be the proposed method is suitable for complex and large scale optimization. The results of the new method have been compared with those obtained by two peak fitting programs. Developed method was found to be very fast and thus it is time saving.

摘要

一种基于进化随机搜索的曲线拟合全局搜索技术被改进,并应用于量化高斯峰和洛伦兹峰的组合。这种基于随机算子的随机搜索过程是一种改进的蒙特卡罗方法。该方法在自行获取的带有随机噪声的多个重叠洛伦兹峰、三维中的 Lennard 粒子以及文献中先前用于优化的离散数学函数上进行了测试。结果发现该方法适用于复杂和大规模的优化。新方法的结果已与通过两个峰拟合程序获得的结果进行了比较。发现所开发的方法非常快速,因此节省时间。

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