Physics-based Penalization for Hyperparameter Estimation in Gaussian Process Regression

COMPUTERS & CHEMICAL ENGINEERING(2023)

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摘要
•Physics-based equality constraints can be applied as soft-constraints through a penalized Maximum-Likelihood estimation function.•Physics-based penalization has a statistically meaningful effect on hyperparameter tuning in Gaussian Process Regression.•Physics-based penalization helps improve the quality of Gaussian Process Regression fit.•Physics-based penalization leads to mitigation of overfitting under sparse data scenarios.
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关键词
Gaussian Process Regression,Maximum Likelihood Estimation,Physics-informed Machine Learning
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