利用噪声数据对高维非线性过程进行稳健的降阶机器学习建模

IF 3 Q2 ENGINEERING, CHEMICAL Digital Chemical Engineering Pub Date : 2024-02-23 DOI:10.1016/j.dche.2024.100145
Wallace Gian Yion Tan, Ming Xiao, Zhe Wu
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引用次数: 0

摘要

基于自编码器的降阶机器学习模型已被开发用于高维度非线性化学过程的建模和预测控制,如反应扩散过程的离散化。然而,在存在数据噪声的情况下,自动编码器可能会过度拟合训练数据,从而学习到不准确的过程变量低维表示。当模型与模型预测控制(MPC)集成时,这会导致预测模型不准确。为解决这一问题,本研究通过将 SpectralDense 层集成到自动编码器中,并将其与递归神经网络相结合,开发了一种基于机器学习的新型降阶建模方法。我们证明,在存在数据噪声的情况下,使用 SpectralDense 层的自编码器新架构比传统自编码器更能防止过拟合,从而提高了 MPC 的预测精度。一个扩散反应过程仿真实例证明,在预测控制的降阶建模中,鲁棒性自编码器优于使用传统层的自编码器。
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Robust reduced-order machine learning modeling of high-dimensional nonlinear processes using noisy data

Autoencoder-based reduced-order machine learning models have been developed for modeling and predictive control of nonlinear chemical processes with high dimensionality such as discretization of reaction–diffusion processes. However, in the presence of data noise, autoencoders may over-fit the training data and subsequently learn an inaccurate low-dimensional representation of the process variables. This leads to an inaccurate prediction model when the models are integrated with model predictive control (MPC). To address this issue, this work develops a novel machine-learning-based reduced-order modeling method by integrating SpectralDense layers into autoencoders and incorporating them with recurrent neural networks. We demonstrate that the new architecture of autoencoders using SpectralDense layers is more robust against over-fitting than conventional autoencoders in the presence of data noise, which improves the prediction accuracy in MPC. A diffusion–reaction process simulation example is used to demonstrate that the robust autoencoders outperform those using conventional layers for reduced-order modeling in predictive control.

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