Promising directions of machine learning for partial differential equations

SL Brunton, JN Kutz - Nature Computational Science, 2024 - nature.com
Partial differential equations (PDEs) are among the most universal and parsimonious
descriptions of natural physical laws, capturing a rich variety of phenomenology and …

Operator learning using random features: A tool for scientific computing

NH Nelsen, AM Stuart - SIAM Review, 2024 - SIAM
Supervised operator learning centers on the use of training data, in the form of input-output
pairs, to estimate maps between infinite-dimensional spaces. It is emerging as a powerful …

Overcoming the timescale barrier in molecular dynamics: Transfer operators, variational principles and machine learning

C Schütte, S Klus, C Hartmann - Acta Numerica, 2023 - cambridge.org
One of the main challenges in molecular dynamics is overcoming the 'timescale barrier': in
many realistic molecular systems, biologically important rare transitions occur on timescales …

Error bounds for learning with vector-valued random features

S Lanthaler, NH Nelsen - Advances in Neural Information …, 2023 - proceedings.neurips.cc
This paper provides a comprehensive error analysis of learning with vector-valued random
features (RF). The theory is developed for RF ridge regression in a fully general infinite …

Machine learning for partial differential equations

SL Brunton, JN Kutz - arxiv preprint arxiv:2303.17078, 2023 - arxiv.org
Partial differential equations (PDEs) are among the most universal and parsimonious
descriptions of natural physical laws, capturing a rich variety of phenomenology and multi …

An operator learning perspective on parameter-to-observable maps

DZ Huang, NH Nelsen, M Trautner - arxiv preprint arxiv:2402.06031, 2024 - arxiv.org
Computationally efficient surrogates for parametrized physical models play a crucial role in
science and engineering. Operator learning provides data-driven surrogates that map …

Towards optimal Sobolev norm rates for the vector-valued regularized least-squares algorithm

Z Li, D Meunier, M Mollenhauer, A Gretton - arxiv preprint arxiv …, 2023 - arxiv.org
We present the first optimal rates for infinite-dimensional vector-valued ridge regression on a
continuous scale of norms that interpolate between $ L_2 $ and the hypothesis space, which …

Optimal estimation of structured covariance operators

O Al-Ghattas, J Chen, D Sanz-Alonso… - arxiv preprint arxiv …, 2024 - arxiv.org
This paper establishes optimal convergence rates for estimation of structured covariance
operators of Gaussian processes. We study banded operators with kernels that decay …

Optimal Rates for Vector-Valued Spectral Regularization Learning Algorithms

D Meunier, Z Shen, M Mollenhauer, A Gretton… - arxiv preprint arxiv …, 2024 - arxiv.org
We study theoretical properties of a broad class of regularized algorithms with vector-valued
output. These spectral algorithms include kernel ridge regression, kernel principal …