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Protein language models have revolutionized structure prediction, but their nonlinear nature obscures how sequence representations inform structure prediction. While sparse autoencoders (SAEs) offer a path to interpretability here by…

Biomolecules · Quantitative Biology 2025-03-13 Nithin Parsan , David J. Yang , John J. Yang

Sparse modeling is a powerful framework for data analysis and processing. Traditionally, encoding in this framework is done by solving an l_1-regularized linear regression problem, usually called Lasso. In this work we first combine the…

Information Theory · Computer Science 2010-03-02 Pablo Sprechmann , Ignacio Ramirez , Guillermo Sapiro , Yonina C. Eldar

A phylogeny describes the evolutionary history of an evolving population. Evolutionary search algorithms can perfectly track the ancestry of candidate solutions, illuminating a population's trajectory through the search space. However,…

Neural and Evolutionary Computing · Computer Science 2024-02-05 Alexander Lalejini , Marcos Sanson , Jack Garbus , Matthew Andres Moreno , Emily Dolson

The rapid advancement of large language models (LLMs) has led to architectures with billions to trillions of parameters, posing significant deployment challenges due to their substantial demands on memory, processing power, and energy…

Machine Learning · Computer Science 2024-07-02 Enshu Liu , Junyi Zhu , Zinan Lin , Xuefei Ning , Matthew B. Blaschko , Shengen Yan , Guohao Dai , Huazhong Yang , Yu Wang

Sparse modelling or model selection with categorical data is challenging even for a moderate number of variables, because one parameter is roughly needed to encode one category or level. The Group Lasso is a well known efficient algorithm…

Methodology · Statistics 2022-11-14 Szymon Nowakowski , Piotr Pokarowski , Wojciech Rejchel , Agnieszka Sołtys

Evolutionary algorithms (EAs) have proven effective in exploring the vast solution spaces typical of graph-structured combinatorial problems. However, traditional encoding schemes, such as binary or numerical representations, often fail to…

Neural and Evolutionary Computing · Computer Science 2025-10-28 Jie Zhao , Kang Hao Cheong

Adapting large language models (LLMs) to a targeted task efficiently and effectively remains a fundamental challenge. Such adaptation often requires iteratively improving the model toward a targeted task, yet collecting high-quality…

Computation and Language · Computer Science 2026-04-30 Ting-Wei Li , Sirui Chen , Jiaru Zou , Yingbing Huang , Tianxin Wei , Jingrui He , Hanghang Tong

Sequence alignments are fundamental to bioinformatics which has resulted in a variety of optimized implementations. Unfortunately, the vast majority of them are hand-tuned and specific to certain architectures and execution models. This not…

Distributed, Parallel, and Cluster Computing · Computer Science 2022-05-17 André Müller , Bertil Schmidt , Andreas Hildebrandt , Richard Membarth , Roland Leißa , Matthis Kruse , Sebastian Hack

Large Language Models (LLMs) have achieved strong complex reasoning capabilities through Chain-of-Thought (CoT) reasoning. However, their reasoning patterns remain too complicated to analyze. While Sparse Autoencoders (SAEs) have emerged as…

Machine Learning · Computer Science 2026-03-04 Xuan Yang , Jiayu Liu , Yuhang Lai , Hao Xu , Zhenya Huang , Ning Miao

Despite strong empirical performance for image classification, deep neural networks are often regarded as ``black boxes'' and they are difficult to interpret. On the other hand, sparse convolutional models, which assume that a signal can be…

Computer Vision and Pattern Recognition · Computer Science 2022-10-25 Xili Dai , Mingyang Li , Pengyuan Zhai , Shengbang Tong , Xingjian Gao , Shao-Lun Huang , Zhihui Zhu , Chong You , Yi Ma

Objective: Social-environmental data obtained from the U.S. Census is an important resource for understanding health disparities, but rarely is the full dataset utilized for analysis. A barrier to incorporating the full data is a lack of…

Applications · Statistics 2020-09-02 Elizabeth Handorf , Yinuo Yin , Michael Slifker , Shannon Lynch

Generating diverse responses is crucial for test-time scaling of large language models (LLMs), yet standard stochastic sampling mostly yields surface-level lexical variation, limiting semantic exploration. In this paper, we propose…

Computation and Language · Computer Science 2026-04-29 Yuanhao Zeng , Ao Lu , Lufei Li , Zheng Zhang , Yexin Li , Kan Ren

Protein structure prediction often hinges on multiple sequence alignments (MSAs), which underperform on low-homology and orphan proteins. We introduce PLAME, a lightweight MSA design framework that leverages evolutionary embeddings from…

Machine Learning · Computer Science 2025-09-29 Hanqun Cao , Xinyi Zhou , Zijun Gao , Chenyu Wang , Xin Gao , Zhi Zhang , Cesar de la Fuente-Nunez , Chunbin Gu , Ge Liu , Pheng-Ann Heng

Bayesian inference methods rely on numerical algorithms for both model selection and parameter inference. In general, these algorithms require a high computational effort to yield reliable estimates. One of the major challenges in…

Quantitative Methods · Quantitative Biology 2018-08-09 Patricio Maturana , Brendon J. Brewer , Steffen Klaere , Remco Bouckaert

In this work, we consider learning sparse models in large scale settings, where the number of samples and the feature dimension can grow as large as millions or billions. Two immediate issues occur under such challenging scenario: (i)…

Machine Learning · Statistics 2023-01-31 Atul Dhingra , Jie Shen , Nicholas Kleene

Interpretable models can have advantages over black-box models, and interpretability is essential for the application of machine learning in critical settings, such as aviation or medicine. This article introduces the LASSO-Clip-EN (LCEN)…

Machine Learning · Computer Science 2025-12-02 Pedro Seber , Richard D. Braatz

Predicting protein function from amino acid sequence remains a central challenge in data-scarce (low-$N$) regimes, limiting machine learning-guided protein design when only small amounts of assay-labeled sequence-function data are…

Machine Learning · Computer Science 2025-08-27 Darin Tsui , Kunal Talreja , Amirali Aghazadeh

Large-scale sparse multi-objective optimization problems (LSMOPs) are prevalent in real-world applications, where optimal solutions typically contain only a few nonzero variables, such as in adversarial attacks, critical node detection, and…

Neural and Evolutionary Computing · Computer Science 2026-03-13 Shuai Shao , Yuhao Sun , Xing Chen , Ye Tian , Guan Wang , Jin Li

We propose Evolutionary Dynamic Loss (EDL), a framework that learns a transferable classification loss in the probability space using unlimited synthetic prediction-label pairs, without accessing real samples during the main loss…

Machine Learning · Computer Science 2026-05-06 Meng Xiang , Yan Pei

The recently proposed Multi-Layer Convolutional Sparse Coding (ML-CSC) model, consisting of a cascade of convolutional sparse layers, provides a new interpretation of Convolutional Neural Networks (CNNs). Under this framework, the…

Computer Vision and Pattern Recognition · Computer Science 2018-07-03 Jeremias Sulam , Vardan Papyan , Yaniv Romano , Michael Elad