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The ultimate goal of a supervised learning algorithm is to produce models constructed on the training data that can generalize well to new examples. In classification, functional margin maximization -- correctly classifying as many training…

Machine Learning · Computer Science 2020-01-29 Nikolaos Nikolaou , Henry Reeve , Gavin Brown

Machine learning (ML) is rapidly transforming the way molecular dynamics simulations are performed and analyzed, from materials modeling to studies of protein folding and function. ML algorithms are often employed to learn low-dimensional…

Soft Condensed Matter · Physics 2025-09-23 Jayashrita Debnath , Gerhard Hummer

The ultimate performance of machine learning algorithms for classification tasks is usually measured in terms of the empirical error probability (or accuracy) based on a testing dataset. Whereas, these algorithms are optimized through the…

Machine Learning · Computer Science 2021-12-13 Matias Vera , Leonardo Rey Vega , Pablo Piantanida

This study introduces the Misclassification Likelihood Matrix (MLM) as a novel tool for quantifying the reliability of neural network predictions under distribution shifts. The MLM is obtained by leveraging softmax outputs and clustering…

Deep learning systems have been reported to acheive state-of-the-art performances in many applications, and one of the keys for achieving this is the existence of well trained classifiers on benchmark datasets which can be used as backbone…

Machine Learning · Computer Science 2022-10-04 Jirong Yi , Qiaosheng Zhang , Zhen Chen , Qiao Liu , Wei Shao

Machine learning (ML) has emerged as a powerful tool for tackling complex regression and classification tasks, yet its success often hinges on the quality of training data. This study introduces an ML paradigm inspired by domain knowledge…

Machine Learning · Computer Science 2025-01-10 Mohsen Rashki

In this paper, we study the problem of learning image classification models in the presence of label noise. We revisit a simple compression regularization named Nested Dropout. We find that Nested Dropout, though originally proposed to…

Computer Vision and Pattern Recognition · Computer Science 2021-04-29 Yingyi Chen , Xi Shen , Shell Xu Hu , Johan A. K. Suykens

Machine learning (ML) explainability is central to algorithmic transparency in high-stakes settings such as predictive diagnostics and loan approval. However, these same domains require rigorous privacy guaranties, creating tension between…

Cryptography and Security · Computer Science 2026-01-08 Firas Ben Hmida , Zain Sbeih , Philemon Hailemariam , Birhanu Eshete

This paper considers the problem of estimating the information leakage of a system in the black-box scenario. It is assumed that the system's internals are unknown to the learner, or anyway too complicated to analyze, and the only available…

Cryptography and Security · Computer Science 2021-11-29 Marco Romanelli , Konstantinos Chatzikokolakis , Catuscia Palamidessi , Pablo Piantanida

Representation learning has been widely studied in the context of meta-learning, enabling rapid learning of new tasks through shared representations. Recent works such as MAML have explored using fine-tuning-based metrics, which measure the…

Machine Learning · Computer Science 2021-05-06 Kurtland Chua , Qi Lei , Jason D. Lee

The goal of a learning algorithm is to receive a training data set as input and provide a hypothesis that can generalize to all possible data points from a domain set. The hypothesis is chosen from hypothesis classes with potentially…

Machine Learning · Statistics 2023-03-29 Soosan Beheshti , Mahdi Shamsi

Despite the increasing prevalence of large language models (LLMs), we still have a limited understanding of how their representational spaces are structured. This limits our ability to interpret how and what they learn or relate them to…

A fundamental principle of learning theory is that there is a trade-off between the complexity of a prediction rule and its ability to generalize. Modern machine learning models do not obey this paradigm: They produce an accurate prediction…

Machine Learning · Computer Science 2021-06-18 Koby Bibas , Meir Feder

Recent advances in autonomous robotic technologies have highlighted the growing need for precise environmental analysis. LiDAR semantic segmentation has gained attention to accomplish fine-grained scene understanding by acting directly on…

Computer Vision and Pattern Recognition · Computer Science 2024-07-10 Elena Camuffo , Umberto Michieli , Simone Milani

The problem of publishing privacy-guaranteed data for hypothesis testing is studied using the maximal leakage (ML) as a metric for privacy and the type-II error exponent as the utility metric. The optimal mechanism (random mapping) that…

Information Theory · Computer Science 2017-04-12 Jiachun Liao , Lalitha Sankar , Flavio P. Calmon , Vincent Y. F. Tan

Pointwise maximal leakage (PML) is a per-outcome privacy measure based on threat models from quantitative information flow. Privacy guarantees with PML rely on knowledge about the distribution that generated the private data. In this work,…

Cryptography and Security · Computer Science 2025-09-29 Leonhard Grosse , Sara Saeidian , Mikael Skoglund , Tobias J. Oechtering

While a broad range of techniques have been proposed to tackle distribution shift, the simple baseline of training on an $\textit{undersampled}$ balanced dataset often achieves close to state-of-the-art-accuracy across several popular…

Machine Learning · Computer Science 2023-06-21 Niladri S. Chatterji , Saminul Haque , Tatsunori Hashimoto

Due to the fundamental connection between next-symbol prediction and compression, modern predictive models, such as large language models (LLMs), can be combined with entropy coding to achieve compression rates that surpass those of…

Information Theory · Computer Science 2026-01-27 Cordelia Hu , Jennifer Tang

Neural networks trained on real-world datasets with long-tailed label distributions are biased towards frequent classes and perform poorly on infrequent classes. The imbalance in the ratio of positive and negative samples for each class…

Computer Vision and Pattern Recognition · Computer Science 2021-05-25 Kevin Duarte , Yogesh S. Rawat , Mubarak Shah

Most real-world problems that machine learning algorithms are expected to solve face the situation with 1) unknown data distribution; 2) little domain-specific knowledge; and 3) datasets with limited annotation. We propose Non-Parametric…

Machine Learning · Computer Science 2022-09-20 Zhiying Jiang , Yiqin Dai , Ji Xin , Ming Li , Jimmy Lin