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Process for data processing and optimization of a neural network for application in the determination of data of physical properties of hydrocarbon products belonging to spectral (near) infrared absorbances

机译:用于确定属于光谱(近)红外吸收度的烃类产品的物理性质数据的神经网络数据处理和优化过程

摘要

A method for data processing and optimisation of a neural network for application in the determination of physical property data of hydrocarbon products from measured (N.)I.R. spectral absorbances, characterized by the steps of: a) measuring the (N.)I.R. spectra of a large set of hydrocarbon product samples from a wide range of sources; b) selecting an overtone (harmonic) region of the (near-)infrared spectra, thus obtained; c) selecting a number of discrete wavelengths in each (N.)I.R. spectrum, converting a number of the said wavelengths to absorption data and using said absorption data as an input to a neural network; d) training the neural network on the entire data set by repeated presentation of inputs and known outputs i.e. the near-infrared data for the hydrocarbon product and its relevant physical property data, to learn the relationship between the two, and monitoring the performance of its predicitions against the actual physical property data as measured by standard methods for the training data, thus correlating the absorbance values with said relevant physical property; e) generating a set of values of the interconnection weights and biases of the network as adjusted after the learning period of step d); and f) applying these adjusted values, utilizing the network algorithm to (near-)infrared spectra, taken under the same conditions, for hydrocarbon products of unknown physical property data.
机译:一种用于神经网络的数据处理和优化的方法,该方法可用于从测量的(N.)I.R。确定烃产品的物理性质数据。光谱吸光度,其特征在于以下步骤:a)测量(N.)I.R。来自各种来源的大量烃产物样品的光谱; b)选择由此获得的(近)红外光谱的泛音(谐波)区域; c)在每个(N.)I.R。中选择多个离散波长光谱,将多个所述波长转换为吸收数据,并将所述吸收数据用作神经网络的输入; d)通过重复呈现输入和已知输出(即碳氢化合物产品的近红外数据及其相关物理特性数据)来训练整个数据集上的神经网络,以了解两者之间的关系,并监控其性能根据通过训练方法的标准方法测得的实际物理性能数据的预测,从而使吸光度值与所述相关物理性能相关; e)生成在步骤d)的学习周期之后调整的一组网络的互连权重和偏置值; f)利用网络算法将这些调整后的值应用到在相同条件下针对未知物理性质数据的碳氢化合物生成的(近)红外光谱。

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