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As the application of large language models in various fields continues to expand, materials science also ushers in opportunities for AI-driven innovation. The traditional way of relying on manual search for materials science-related…

Artificial Intelligence · Computer Science 2024-11-14 Chao Huang , Huichen Xiao , Chen Chen , Chunyan Chen , Yi Zhao , Shiyu Du , Yiming Zhang , He Sha , Ruixin Gu

Radiology reports capture crucial longitudinal information on tumor burden, treatment response, and disease progression, yet their unstructured narrative format complicates automated analysis. While large language models (LLMs) have…

Computation and Language · Computer Science 2026-03-12 Luc Builtjes , Alessa Hering

With the booming of Large Language Models (LLMs), prompt-learning has become a promising method mainly researched in various research areas. Recently, many attempts based on prompt-learning have been made to improve the performance of text…

Computation and Language · Computer Science 2024-06-07 Chun Liu , Hongguang Zhang , Kainan Zhao , Xinghai Ju , Lin Yang

In real world, our datasets often contain outliers. Moreover, the outliers can seriously affect the final machine learning result. Most existing algorithms for handling outliers take high time complexities (e.g. quadratic or cubic…

Computational Geometry · Computer Science 2020-02-28 Hu Ding , Zixiu Wang

String Kernel (SK) techniques, especially those using gapped $k$-mers as features (gk), have obtained great success in classifying sequences like DNA, protein, and text. However, the state-of-the-art gk-SK runs extremely slow when we…

Machine Learning · Computer Science 2017-09-19 Ritambhara Singh , Arshdeep Sekhon , Kamran Kowsari , Jack Lanchantin , Beilun Wang , Yanjun Qi

The recent framework of compressive statistical learning aims at designing tractable learning algorithms that use only a heavily compressed representation-or sketch-of massive datasets. Compressive K-Means (CKM) is such a method: it…

Machine Learning · Computer Science 2018-08-01 Vincent Schellekens , Laurent Jacques

This paper describes a method for clustering data that are spread out over large regions and which dimensions are on different scales of measurement. Such an algorithm was developed to implement a robotics application consisting in sorting…

Machine Learning · Computer Science 2017-03-23 Joris Guérin , Olivier Gibaru , Stéphane Thiery , Eric Nyiri

The k-means method is one of the most widely used clustering algorithms, drawing its popularity from its speed in practice. Recently, however, it was shown to have exponential worst-case running time. In order to close the gap between…

Data Structures and Algorithms · Computer Science 2009-08-07 David Arthur , Bodo Manthey , Heiko Röglin

To cluster data that are not linearly separable in the original feature space, $k$-means clustering was extended to the kernel version. However, the performance of kernel $k$-means clustering largely depends on the choice of kernel…

Machine Learning · Computer Science 2018-11-02 Yaqiang Yao , Huanhuan Chen

O1/R1 style large reasoning models (LRMs) signal a substantial leap forward over conventional instruction-following LLMs. By applying test-time scaling to generate extended reasoning paths, they establish many SOTAs across a wide range of…

Artificial Intelligence · Computer Science 2025-09-09 Wei Han , Geng Zhan , Sicheng Yu , Chenyu Wang , Bryan Hooi

Centroid based clustering methods such as k-means, k-medoids and k-centers are heavily applied as a go-to tool in exploratory data analysis. In many cases, those methods are used to obtain representative centroids of the data manifold for…

Machine Learning · Computer Science 2022-06-16 Ahmed Imtiaz Humayun , Randall Balestriero , Anastasios Kyrillidis , Richard Baraniuk

Clustering is a fundamental tool in unsupervised learning, used to group objects by distinguishing between similar and dissimilar features of a given data set. One of the most common clustering algorithms is k-means. Unfortunately, when…

Machine Learning · Statistics 2021-08-17 Olga Dorabiala , J. Nathan Kutz , Aleksandr Aravkin

Code comprehension has been recently investigated from physiological and cognitive perspectives through the use of medical imaging. Floyd et al (i.e., the original study) used fMRI to classify the type of comprehension tasks performed by…

Software Engineering · Computer Science 2019-04-04 Davide Fucci , Daniela Girardi , Nicole Novielli , Luigi Quaranta , Filippo Lanubile

Large Language Models (LLMs) with their strong task-handling capabilities have shown remarkable advancements across a spectrum of fields, moving beyond natural language understanding. However, their proficiency within the chemistry domain…

Computer Vision and Pattern Recognition · Computer Science 2026-02-02 Khiem Le , Zhichun Guo , Kaiwen Dong , Xiaobao Huang , Bozhao Nan , Roshni Iyer , Xiangliang Zhang , Olaf Wiest , Wei Wang , Ting Hua , Nitesh V. Chawla

This paper introduces Geometric-k-means (or Gk-means for short), a novel approach that significantly enhances the efficiency and energy economy of the widely utilized k-means algorithm, which, despite its inception over five decades ago,…

Machine Learning · Computer Science 2025-08-11 Parichit Sharma , Marcin Stanislaw , Hasan Kurban , Oguzhan Kulekci , Mehmet Dalkilic

Large Language Models (LLMs) incur significant computational and memory costs when processing long prompts, as full self-attention scales quadratically with input length. Token compression aims to address this challenge by reducing the…

Computation and Language · Computer Science 2026-04-23 Zihao Xu , John Harvill , Ziwei Fan , Yizhou Sun , Hao Ding , Hao Wang

Motivation: Seed location filtering is critical in DNA read mapping, a process where billions of DNA fragments (reads) sampled from a donor are mapped onto a reference genome to identify genomic variants of the donor. State-of-the-art read…

Large language models (LLMs) enable long-context tasks but face efficiency challenges due to the growing key-value (KV) cache. We propose LeanK, a learning-based method that prunes unimportant key (K) cache channels by leveraging static…

Machine Learning · Computer Science 2025-08-05 Yike Zhang , Zhiyuan He , Huiqiang Jiang , Chengruidong Zhang , Yuqing Yang , Jianyong Wang , Lili Qiu

The advent of high-throughput sequencing technologies constituted a major advance in genomic studies, offering new prospects in a wide range of applications. We propose a rigorous and flexible algorithmic solution to mapping SOLiD…

Quantitative Methods · Quantitative Biology 2011-01-18 Laurent Noé , Marta L. Gîrdea , Gregory Kucherov

Structured pruning of modern large language models (LLMs) has emerged as a way of decreasing their high computational needs. Width pruning reduces the size of projection weight matrices (e.g., by removing attention heads) while maintaining…

Machine Learning · Computer Science 2024-06-25 Bo-Kyeong Kim , Geonmin Kim , Tae-Ho Kim , Thibault Castells , Shinkook Choi , Junho Shin , Hyoung-Kyu Song