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Machine learning interatomic potentials (MLIPs) enable efficient molecular dynamics (MD) simulations with ab initio accuracy and have been applied across various domains in physical science. However, their performance often relies on…

Computational Physics · Physics 2025-07-29 Taoyong Cui , Zhongyao Wang , Dongzhan Zhou , Yuqiang Li , Lei Bai , Wanli Ouyang , Mao Su , Shufei Zhang

The reliable application of deep learning models to software engineering tasks hinges on high-quality training data. Yet, large-scale repositories inevitably introduce noisy or mislabeled examples that degrade both accuracy and robustness.…

Software Engineering · Computer Science 2025-12-05 Zixiao Zhao , Fatemeh H. Fard , Jie JW Wu

Large-scale NLP models have been shown to significantly improve the performance on language tasks with no signs of saturation. They also demonstrate amazing few-shot capabilities like that of human beings. This paper aims to explore…

Computer Vision and Pattern Recognition · Computer Science 2022-04-12 Ze Liu , Han Hu , Yutong Lin , Zhuliang Yao , Zhenda Xie , Yixuan Wei , Jia Ning , Yue Cao , Zheng Zhang , Li Dong , Furu Wei , Baining Guo

Scaling up deep neural network capacity has been known as an effective approach to improving model quality for several different machine learning tasks. In many cases, increasing model capacity beyond the memory limit of a single…

Computer Vision and Pattern Recognition · Computer Science 2019-07-29 Yanping Huang , Youlong Cheng , Ankur Bapna , Orhan Firat , Mia Xu Chen , Dehao Chen , HyoukJoong Lee , Jiquan Ngiam , Quoc V. Le , Yonghui Wu , Zhifeng Chen

Supervised Fine-Tuning (SFT) Large Language Models (LLM) fundamentally rely on high-quality training data. While data selection and data synthesis are two common strategies to improve data quality, existing approaches often face limitations…

Computation and Language · Computer Science 2025-10-23 Zinan Tang , Xin Gao , Qizhi Pei , Zhuoshi Pan , Mengzhang Cai , Jiang Wu , Conghui He , Lijun Wu

We consider a discrete optimization formulation for learning sparse classifiers, where the outcome depends upon a linear combination of a small subset of features. Recent work has shown that mixed integer programming (MIP) can be used to…

Machine Learning · Statistics 2021-06-08 Antoine Dedieu , Hussein Hazimeh , Rahul Mazumder

Despite the significant potential of FP8 data formats for large language model (LLM) pre-training, their adoption has been limited due to challenges in maintaining stability at scale. Existing approaches often rely on suboptimal…

Machine Learning · Computer Science 2025-10-28 Alejandro Hernández-Cano , Dhia Garbaya , Imanol Schlag , Martin Jaggi

Training large-scale distributed machine learning models imposes considerable demands on network infrastructure, often resulting in sudden traffic spikes that lead to congestion, increased latency, and reduced throughput, which would…

Distributed, Parallel, and Cluster Computing · Computer Science 2025-06-23 Yisu Wang , Xinjiao Li , Ruilong Wu , Huangxun Chen , Dirk Kutscher

Large-scale cross-modal pre-training paradigms have recently shown ubiquitous success on a wide range of downstream tasks, e.g., zero-shot classification, retrieval and image captioning. However, their successes highly rely on the scale and…

Computer Vision and Pattern Recognition · Computer Science 2023-01-05 Runhui Huang , Yanxin Long , Jianhua Han , Hang Xu , Xiwen Liang , Chunjing Xu , Xiaodan Liang

Mixed Integer Linear Programming (MILP) is essential for modeling complex decision-making problems but faces challenges in computational tractability and requires expert formulation. Current deep learning approaches for MILP focus on…

Machine Learning · Computer Science 2025-02-24 Sirui Li , Janardhan Kulkarni , Ishai Menache , Cathy Wu , Beibin Li

How can we effectively handle queries for on-device large language models (LLMs) with varying runtime constraints, such as latency and accuracy? Multi-scale quantization addresses this challenge by enabling memory-efficient runtime model…

Machine Learning · Computer Science 2025-12-09 Sangwoo Kwon , Seong Hoon Seo , Jae W. Lee , Yeonhong Park

Multimodal Large Language Models (MLLMs) demonstrate exceptional semantic reasoning but struggle with 3D spatial perception when restricted to pure RGB inputs. Despite leveraging implicit geometric priors from 3D reconstruction models,…

Computer Vision and Pattern Recognition · Computer Science 2026-03-18 Jiaxin Zhang , Junjun Jiang , Haijie Li , Youyu Chen , Kui Jiang , Dave Zhenyu Chen

Multimodal Large Language Models (MLLMs) are undergoing rapid progress and represent the frontier of AI development. However, their training and inference efficiency have emerged as a core bottleneck in making MLLMs more accessible and…

Large language models (LLMs) have made significant strides in complex tasks, yet their widespread adoption is impeded by substantial computational demands. With hundreds of billion parameters, transformer-based LLMs necessitate months of…

Machine Learning · Computer Science 2024-08-22 Pihe Hu , Shaolong Li , Longbo Huang

In recent years, large language models (LLMs) have achieved remarkable success in natural language processing (NLP). LLMs require an extreme amount of parameters to attain high performance. As models grow into the trillion-parameter range,…

Computation and Language · Computer Science 2024-09-10 Zhyar Rzgar K Rostam , Sándor Szénási , Gábor Kertész

Mixed Integer Linear Programs (MILPs) are essential tools for solving planning and scheduling problems across critical industries such as construction, manufacturing, and logistics. However, their widespread adoption is limited by long…

Machine Learning · Computer Science 2025-06-10 Xiaoke Wang , Batuhan Altundas , Zhaoxin Li , Aaron Zhao , Matthew Gombolay

Large Language Models (LLMs) today are powerful problem solvers across many domains, and they continue to get stronger as they scale in model size, training set size, and training set quality, as shown by extensive research and…

Recent advancements in large language models (LLMs) have significantly improved code generation and program comprehension, accelerating the evolution of software engineering. Current methods primarily enhance model performance by leveraging…

Computation and Language · Computer Science 2025-07-04 Weijie Lyu , Sheng-Jun Huang , Xuan Xia

Neural network potentials (NNPs) are crucial for accelerating computational materials science by surrogating density functional theory (DFT) calculations. Improving their accuracy is possible through pre-training and fine-tuning, where an…

Machine Learning · Computer Science 2025-05-29 Yosuke Oyama , Yusuke Majima , Eiji Ohta , Yasufumi Sakai

Unsupervised large-scale vision-language pre-training has shown promising advances on various downstream tasks. Existing methods often model the cross-modal interaction either via the similarity of the global feature of each modality which…

Computer Vision and Pattern Recognition · Computer Science 2021-11-16 Lewei Yao , Runhui Huang , Lu Hou , Guansong Lu , Minzhe Niu , Hang Xu , Xiaodan Liang , Zhenguo Li , Xin Jiang , Chunjing Xu