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The rapid evolution of machine learning (ML) has led to the widespread adoption of complex "black box" models, such as deep neural networks and ensemble methods. These models exhibit exceptional predictive performance, making them…

机器学习 · 计算机科学 2025-03-28 Moncef Garouani , Josiane Mothe , Ayah Barhrhouj , Julien Aligon

In this paper, we present a thorough theoretical analysis of the default implementation of LIME in the case of tabular data. We prove that in the large sample limit, the interpretable coefficients provided by Tabular LIME can be computed in…

机器学习 · 统计学 2022-07-19 Damien Garreau , Ulrike von Luxburg

Accurate molecular property prediction requires integrating complementary information from molecular structure and chemical semantics. In this work, we propose LGM-CL, a local-global multimodal contrastive learning framework that jointly…

机器学习 · 计算机科学 2026-02-02 Xiayu Liu , Zhengyi Lu , Yunhong Liao , Chan Fan , Hou-biao Li

Deep learning is increasingly used in decision-making tasks. However, understanding how neural networks produce final predictions remains a fundamental challenge. Existing work on interpreting neural network predictions for images often…

人机交互 · 计算机科学 2019-09-04 Fred Hohman , Haekyu Park , Caleb Robinson , Duen Horng Chau

When training automated systems, it has been shown to be beneficial to adapt the representation of data by learning a problem-specific metric. This metric is global. We extend this idea and, for the widely used family of k nearest neighbors…

机器学习 · 计算机科学 2021-09-30 Jan Philip Göpfert , Heiko Wersing , Barbara Hammer

Protein language models (PLMs) have revolutionised computational biology through their ability to generate powerful sequence representations for diverse prediction tasks. However, their black-box nature limits biological interpretation and…

生物大分子 · 定量生物学 2025-04-11 Jan van Eck , Dea Gogishvili , Wilson Silva , Sanne Abeln

The ability to interpret decisions taken by Machine Learning (ML) models is fundamental to encourage trust and reliability in different practical applications. Recent interpretation strategies focus on human understanding of the underlying…

机器学习 · 计算机科学 2024-09-05 Adit Agarwal , K. K. Shukla , Arjan Kuijper , Anirban Mukhopadhyay

Despite the recent success on image classification, self-training has only achieved limited gains on structured prediction tasks such as neural machine translation (NMT). This is mainly due to the compositionality of the target space, where…

计算与语言 · 计算机科学 2020-12-08 Minkai Xu , Mingxuan Wang , Zhouhan Lin , Hao Zhou , Weinan Zhang , Lei Li

In many problems of supervised tensor learning (STL), real world data such as face images or MRI scans are naturally represented as matrices, which are also called as second order tensors. Most existing classifiers based on tensor…

机器学习 · 统计学 2018-12-20 Yunfei Ye

We explore the application of computer vision and machine learning (ML) techniques to predict material properties (e.g. compressive strength) based on SEM images. We show that it's possible to train ML models to predict materials…

Large Language Models (LLMs) are becoming increasingly popular in pervasive computing due to their versatility and strong performance. However, despite their ubiquitous use, the exact mechanisms underlying their outstanding performance…

计算与语言 · 计算机科学 2026-02-02 Alhassan Abdelhalim , Janick Edinger , Sören Laue , Michaela Regneri

As a multitude of capable machine learning (ML) models become widely available in forms such as open-source software and public APIs, central questions remain regarding their use in real-world applications, especially in high-stakes…

机器学习 · 计算机科学 2024-06-03 Dimitris Bertsimas , Matthew Peroni

In self-supervised learning (SSL), representations are learned via an auxiliary task without annotated labels. A common task is to classify augmentations or different modalities of the data, which share semantic content (e.g. an object in…

机器学习 · 计算机科学 2024-10-16 Alice Bizeul , Bernhard Schölkopf , Carl Allen

Large language models (LLMs) have demonstrated exceptional proficiency in understanding and generating human language, but efficient inference on resource-constrained embedded devices remains challenging due to large model sizes and…

硬件体系结构 · 计算机科学 2025-07-15 Weihong Xu , Haein Choi , Po-kai Hsu , Shimeng Yu , Tajana Rosing

Large Language Models (LLMs) fine-tuned on serialized tabular data are emerging as powerful alternatives to traditional tree-based models, particularly for heterogeneous or context-rich datasets. However, their deployment in high-stakes…

机器学习 · 计算机科学 2026-04-24 Aryan Chaudhary , Prateek Agarwal , Tejasvi Alladi

In this paper we show that our Machine Learning (ML) approach, CoMLSim (Composable Machine Learning Simulator), can simulate PDEs on highly-resolved grids with higher accuracy and generalization to out-of-distribution source terms and…

机器学习 · 计算机科学 2022-10-13 Rishikesh Ranade , Chris Hill , Lalit Ghule , Jay Pathak

Recent years have seen important advances in the building of interpretable models, machine learning models that are designed to be easily understood by humans. In this work, we show that large language models (LLMs) are remarkably good at…

机器学习 · 计算机科学 2024-02-23 Sebastian Bordt , Ben Lengerich , Harsha Nori , Rich Caruana

Image super-resolution (SR) techniques have been developing rapidly, benefiting from the invention of deep networks and its successive breakthroughs. However, it is acknowledged that deep learning and deep neural networks are difficult to…

计算机视觉与模式识别 · 计算机科学 2021-08-24 Jinjin Gu , Chao Dong

In-context learning (ICL) and supervised fine-tuning (SFT) are two common strategies for improving the performance of modern large language models (LLMs) on specific tasks. Despite their different natures, these strategies often lead to…

计算与语言 · 计算机科学 2024-09-10 Diego Doimo , Alessandro Serra , Alessio Ansuini , Alberto Cazzaniga

Sparse autoencoders (SAEs) have become a standard tool for mechanistic interpretability in autoregressive large language models (LLMs), enabling researchers to extract sparse, human-interpretable features and intervene on model behavior.…

机器学习 · 计算机科学 2026-02-06 Xu Wang , Bingqing Jiang , Yu Wan , Baosong Yang , Lingpeng Kong , Difan Zou
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