arXiv:2508. 08517v2 Announce Type: replace-cross Abstract: Surrogate modeling for systems with high-dimensional quantities of interest remains challenging, particularly when training data are costly to acquire.
By Vignesh Sella, Julie Pham, Karen Willcox, Anirban Chaudhuri
arXiv:2607. 07863v1 Announce Type: new Abstract: In physically dominated machining processes, experimental datasets are small, expensive, and material-specific; in this regime, data curation, evaluation design, and the form of physics integration can matter as much as the learning algorithm.
By Sarah Grewe, J\"org Frochte
arXiv:2608. 13793v1 Announce Type: cross Abstract: Machine learning (ML) has become an indispensable part of modern engineering design workflows.
By Tyler R. Johnson, Kian Ben-Jacob, Christopher P. Muller, Ramin Bostanabad
arXiv:2607. 23404v1 Announce Type: new Abstract: Self-driving laboratories increasingly rely on multi-fidelity Bayesian optimization (MFBO) to balance cheap, approximate evaluations against scarce, expensive ones, with a predictive surrogate at its core.
By Jaewook Lee, Ethan Errington, Christian D. Lorenz, Miao Guo
arXiv:2607. 29225v1 Announce Type: new Abstract: Bayesian Optimization (BO) is widely adopted for data-efficient optimization in scientific and engineering applications, yet its computational cost is rarely evaluated alongside optimization performance.
By Panagiotis Krokidas, Christoforos Rekatsinas, Vassilis Sioros, Grigorios M. Chatziathanasiou, Efi-Maria Papia, George Giannakopoulos
arXiv:2607. 21773v1 Announce Type: new Abstract: In this paper, we propose and study a robust variant of the smart predict-then-optimize approach that accounts for prediction shifts due to disturbance in the covariate feature space.
By Aakil Caunhye, Xuefei Lu, Belen Martin-Barragan
arXiv:2602. 00072v2 Announce Type: replace Abstract: The performance of machine learning surrogates is critically dependent on data quality and quantity.
By Jice Zeng, David Barajas-Solano, Hui Chen
arXiv:2303. 08777v3 Announce Type: replace-cross Abstract: Cross-validation is one of the most widely used tools for risk estimation and model selection in statistics and machine learning, yet its theoretical properties when embedded in a learning procedure remain insufficiently understood.
By Diego Marcondes, Cl\'audia Peixoto
arXiv:2608. 06107v1 Announce Type: new Abstract: Machine learning offers a promising avenue to accelerate physical simulations by replacing computationally expensive traditional Partial Differential Equation (PDE) solvers with fast, differentiable surrogate models.
By Guillaume Couairon, Alexis Jacq, Yu-Han Wu, Renu Singh, Yana Hasson, Quentin Berthet, Romuald Elie
arXiv:2608. 09071v1 Announce Type: cross Abstract: Forward uncertainty propagation in complex physical systems can induce structured covariance across field-valued outputs.
By Yupei Nie, Lei Wang, Jiasen Liu
arXiv:2607. 06252v1 Announce Type: cross Abstract: Many problems in science and engineering are difficult to model accurately, either due to unknown physical mechanisms, poorly quantified measurement uncertainty, or prohibitive computational costs of high-fidelity simulations.
By Fabian Schneider, Tapio Helin, Leila Taghizadeh
arXiv:2606. 27269v1 Announce Type: cross Abstract: Reliably quantifying predictive uncertainty is difficult for complex, high-dimensional, or misspecified models.
By Graham Gibson, John Tipton, Kellin Rumsey, Natalie Klein