arXiv Machine Learning

Reframing preprocessing selection as model-internal calibration in near-infrared spectroscopy: A large-scale benchmark of operator-adaptive PLS and Ridge models

arXiv:2605. 13587v3 Announce Type: replace-cross Abstract: Preprocessing screening is often the most expensive part of a near-infrared spectroscopy calibration workflow.

arXiv Machine Learning
Jul 2

Spectroscopy Analysis with Machine Learning Regression for the Quantification of Carbon and Nitrogen Contents in Inceptisol and Oxisol Soil Types: Comparing Different Preprocessing and Validation methods as well as Feature Importance

arXiv:2607. 00834v1 Announce Type: new Abstract: Near-Infrared (NIR) spectroscopy has emerged as a promising alternative to traditional soil analysis methods, offering advantages such as speed, low cost, and non-destructive testing.

By Vinicius Herique Kieling, Guilherme Macedo Baggio, Felipe Augusto Bueno Rossi, Marco Antonio de Castro Barbosa, Dalcimar Casanova, Larissa Macedo dos Santos Tonial, Jefferson Tales Oliva
arXiv Machine Learning
Jul 20

Improving Improved Kernel PLS

arXiv:2607. 16138v1 Announce Type: new Abstract: Improved Kernel Partial Least Squares (IKPLS) algorithms 1 and 2 are among the fastest PLS calibration algorithms.

By Ole-Christian Galbo Engstr{\o}m
arXiv Machine Learning
Aug 27

Adaptive Regularization for Random Features: A Neighboring Early-Stopping Rule with Oracle-Rate Guarantees

The paper introduces a neighboring early‑stopping rule for adaptive regularization in kernel ridge regression with random features (KRR‑RF). By using a uniform grid in inverse regularization and comparing only adjacent estimators, the method reduces discrepancy checks and can be computed directly in the random‑feature space without forming the full kernel Gram matrix. Under standard source and capacity assumptions, the selected estimator achieves the oracle polynomial learning rate up to logarithmic factors, enabling regularization selection without prior knowledge of smoothness or capacity exponents.

By Caixing Wang, Zhibo Chen, Yue Wang