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Advancements in theoretical and algorithmic approaches, workflow engines, and an ever-increasing computational power have enabled a novel paradigm for materials discovery through first-principles high-throughput simulations. A major…

Distortion Risk Measures (DRMs) capture risk preferences in decision-making and serve as general criteria for managing uncertainty. This paper proposes gradient descent algorithms for DRM optimization based on two dual representations: the…

Machine Learning · Computer Science 2025-10-07 Jinyang Jiang , Bernd Heidergott , Jiaqiao Hu , Yijie Peng

Methods for carefully selecting or generating a small set of training data to learn from, i.e., data pruning, coreset selection, and data distillation, have been shown to be effective in reducing the ever-increasing cost of training neural…

Density Functional Theory (DFT) has become a cornerstone in the modeling of metals. However, accurately simulating metals, particularly under extreme conditions, presents two significant challenges. First, simulating complex metallic…

Chemical Physics · Physics 2024-03-08 Jake P. Vu , Ming Chen

With the dramatically increased number of parameters in language models, sparsity methods have received ever-increasing research focus to compress and accelerate the models. While most research focuses on how to accurately retain…

Artificial Intelligence · Computer Science 2022-05-24 Yuchao Li , Fuli Luo , Chuanqi Tan , Mengdi Wang , Songfang Huang , Shen Li , Junjie Bai

Rough set is one of the important methods for rule acquisition and attribute reduction. The current goal of rough set attribute reduction focuses more on minimizing the number of reduced attributes, but ignores the spatial similarity…

Artificial Intelligence · Computer Science 2024-05-16 Xuchang Guo , Houbiao Li

Global instability analysis of flows is often performed via time-stepping methods, based on the Arnoldi algorithm. When setting up these methods, several computational parameters must be chosen, which affect intrinsic errors of the…

Fluid Dynamics · Physics 2022-11-10 Marlon Sproesser Mathias , Marcello Augusto Faraco de Medeiros

Psychiatric neuroscience is increasingly aware of the need to define psychopathology in terms of abnormal neural computation. The central tool in this endeavour is the fitting of computational models to behavioural data. The most prominent…

Quantitative Methods · Quantitative Biology 2018-03-28 Abraham Nunes , Alexander Rudiuk

Recent research on deep convolutional neural networks (CNNs) has provided a significant performance boost on efficient super-resolution (SR) tasks by trading off the performance and applicability. However, most existing methods focus on…

Image and Video Processing · Electrical Eng. & Systems 2023-12-25 Yan Wang , Tongtong Su , Yusen Li , Jiuwen Cao , Gang Wang , Xiaoguang Liu

Utility-driven mining is an important task in data science and has many applications in real life. High utility sequential pattern mining (HUSPM) is one kind of utility-driven mining. HUSPM aims to discover all sequential patterns with high…

Databases · Computer Science 2021-12-01 Gengsen Huang , Wensheng Gan , Jian Weng , Philip S. Yu

Compression methods, including quantization, distillation, and pruning, improve the computational efficiency of large reasoning models (LRMs). However, existing studies either fail to sufficiently compare all three compression methods on…

Machine Learning · Computer Science 2026-03-03 Nan Zhang , Eugene Kwek , Yusen Zhang , Ngoc-Hieu Nguyen , Prasenjit Mitra , Rui Zhang

Existing chain-of-thought (CoT) distillation methods can effectively transfer reasoning abilities to base models but suffer from two major limitations: excessive verbosity of reasoning traces and inadequate adaptability to problem…

Artificial Intelligence · Computer Science 2025-05-27 Yifan Wu , Jingze Shi , Bingheng Wu , Jiayi Zhang , Xiaotian Lin , Nan Tang , Yuyu Luo

Poyiadjis et al. (2011) show how particle methods can be used to estimate both the score and the observed information matrix for state space models. These methods either suffer from a computational cost that is quadratic in the number of…

Computation · Statistics 2015-09-07 Christopher Nemeth , Paul Fearnhead , Lyudmila Mihaylova

This paper presents an original method of fuzzy approximate reasoning that can open a new direction of research in the uncertainty inference of Artificial Intelligence(AI) and Computational Intelligence(CI). Fuzzy modus ponens (FMP) and…

Artificial Intelligence · Computer Science 2020-03-31 I. M. Son , S. I. Kwak , U. J. Han , J. H. Pak , M. Han , J. R. Pyon , U. S. Ryu

A determinantal point process is a stochastic point process that is commonly used to capture negative correlations. It has become increasingly popular in machine learning in recent years. Sampling a determinantal point process however…

Numerical Analysis · Mathematics 2020-09-02 Lexing Ying

Recent Large Reasoning Models (LRMs) have achieved remarkable performance in solving complex problems via supervised fine-tuning (SFT) and reinforcement learning (RL). Although existing RL algorithms significantly enhance model accuracy,…

Artificial Intelligence · Computer Science 2025-10-20 Zezhong Tan , Hang Gao , Xinhong Ma , Feng Zhang , Ziqiang Dong

Neurite Orientation Dispersion and Density Imaging (NODDI) is an important imaging technology used to evaluate the microstructure of brain tissue, which is of great significance for the discovery and treatment of various neurological…

Computer Vision and Pattern Recognition · Computer Science 2024-08-06 Taohui Xiao , Jian Cheng , Wenxin Fan , Jing Yang , Cheng Li , Enqing Dong , Shanshan Wang

Although deep Reinforcement Learning (RL) has proven successful in a wide range of tasks, one challenge it faces is interpretability when applied to real-world problems. Saliency maps are frequently used to provide interpretability for deep…

Machine Learning · Computer Science 2022-05-19 Jinwei Xing , Takashi Nagata , Xinyun Zou , Emre Neftci , Jeffrey L. Krichmar

Efficient vision-language understanding of large Remote Sensing Images (RSIs) is meaningful but challenging. Current Large Vision-Language Models (LVLMs) typically employ limited pre-defined grids to process images, leading to information…

Computer Vision and Pattern Recognition · Computer Science 2025-07-25 Junwei Luo , Yingying Zhang , Xue Yang , Kang Wu , Qi Zhu , Lei Liang , Jingdong Chen , Yansheng Li

Large language models (LLMs), especially Explicit Long Chain-of-Thought (CoT) reasoning models like DeepSeek-R1 and QWQ, have demonstrated powerful reasoning capabilities, achieving impressive performance in commonsense reasoning and…

Computation and Language · Computer Science 2025-08-13 Jiatong Li , Weida Wang , Qinggang Zhang , Junxian Li , Di Zhang , Changmeng Zheng , Shufei Zhang , Xiaoyong Wei , Qing Li
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