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Linking Gaussian process regression with data-driven manifold embeddings for nonlinear data fusion.

Seungjoon LeeFelix DietrichGeorge Em KarniadakisIoannis G Kevrekidis
Published in: Interface focus (2019)
In statistical modelling with Gaussian process regression, it has been shown that combining (few) high-fidelity data with (many) low-fidelity data can enhance prediction accuracy, compared to prediction based on the few high-fidelity data only. Such information fusion techniques for multi-fidelity data commonly approach the high-fidelity model f h(t) as a function of two variables (t, s), and then use f l(t) as the s data. More generally, the high-fidelity model can be written as a function of several variables (t, s 1, s 2….); the low-fidelity model f l and, say, some of its derivatives can then be substituted for these variables. In this paper, we will explore mathematical algorithms for multi-fidelity information fusion that use such an approach towards improving the representation of the high-fidelity function with only a few training data points. Given that f h may not be a simple function-and sometimes not even a function-of f l, we demonstrate that using additional functions of t, such as derivatives or shifts of f l, can drastically improve the approximation of f h through Gaussian processes. We also point out a connection with 'embedology' techniques from topology and dynamical systems. Our illustrative examples range from instructive caricatures to computational biology models, such as Hodgkin-Huxley neural oscillations.
Keyphrases
  • electronic health record
  • big data
  • healthcare
  • deep learning
  • social media
  • molecular dynamics
  • health information
  • molecular docking
  • molecular dynamics simulations