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Precise recognition, editing, and generation of molecules are essential prerequisites for both chemists and AI systems tackling various chemical tasks. We present MolLangBench, a comprehensive benchmark designed to evaluate fundamental…

Computation and Language · Computer Science 2026-03-24 Feiyang Cai , Jiahui Bai , Tao Tang , Guijuan He , Joshua Luo , Tianyu Zhu , Srikanth Pilla , Gang Li , Ling Liu , Feng Luo

Large Language Models (LLMs) inference is central to modern AI applications, dominating worldwide datacenter workloads, making it critical to predict its energy footprint. Existing approaches estimate energy consumption as a simple linear…

Recent breakthroughs in Large-scale language models (LLMs) have demonstrated impressive performance on various tasks. The immense sizes of LLMs have led to very high resource demand and cost for running the models. Though the models are…

Machine Learning · Computer Science 2024-03-05 Juntao Zhao , Borui Wan , Yanghua Peng , Haibin Lin , Chuan Wu

Autonomous agents have recently achieved remarkable progress across diverse domains, yet most evaluations focus on short-horizon, fully observable tasks. In contrast, many critical real-world tasks, such as large-scale software development,…

Network foundation models promise reusable representations for diverse traffic analysis tasks, but recent diagnostic works have revealed fundamental problems: models exploit dataset shortcuts rather than learning genuine traffic patterns,…

Networking and Internet Architecture · Computer Science 2026-05-13 Sylee Beltiukov , Satyandra Guthula , Haarika Manda , Jaber Daneshamooz , Wenbo Guo , Walter Willinger , Arpit Gupta , Inder Monga

The latency and power consumption of large language models (LLMs) are major constraints when serving them across a wide spectrum of hardware platforms, from mobile edge devices to cloud GPU clusters. Benchmarking is crucial for optimizing…

Distributed, Parallel, and Cluster Computing · Computer Science 2025-12-12 Hung-Yueh Chiang , Bokun Wang , Diana Marculescu

Transformer-based large language models (LLMs) have achieved remarkable success, yet their standard attention mechanism incurs quadratic computation and memory costs with respect to sequence length, posing a major bottleneck for…

Machine Learning · Computer Science 2025-10-22 Tao Bu , Qiangang Wang , Bowen Zeng , Hanwen Sun , Yunpeng Huang , Chun Cao , Jingwei Xu

Deep learning kernels exhibit predictable memory accesses and compute patterns, making GPUs' parallel architecture well-suited for their execution. Software and runtime systems for GPUs are optimized to better utilize the stream…

Machine Learning · Computer Science 2024-12-13 Seonho Lee , Amar Phanishayee , Divya Mahajan

Transformer-based models are the state-of-the-art for Natural Language Understanding (NLU) applications. Models are getting bigger and better on various tasks. However, Transformer models remain computationally challenging since they are…

Computation and Language · Computer Science 2020-10-27 Young Jin Kim , Hany Hassan Awadalla

The rise of generative models has raised concerns about image authenticity online, highlighting the urgent need for a detector that is (1) highly generalizable, capable of handling unseen forgery techniques, and (2) data-efficient,…

Computer Vision and Pattern Recognition · Computer Science 2025-07-01 Yingjian Chen , Lei Zhang , Yakun Niu

AMD GPUs offer state-of-the-art compute and memory bandwidth; however, peak performance AMD kernels are written in raw assembly. To address the difficulty of mapping AI algorithms to hardware, recent work proposes C++ embedded and…

Scientific workloads have traditionally exploited high levels of sparsity to accelerate computation and reduce memory requirements. While deep neural networks can be made sparse, achieving practical speedups on GPUs is difficult because…

Machine Learning · Computer Science 2020-09-02 Trevor Gale , Matei Zaharia , Cliff Young , Erich Elsen

For large-scale graph analytics on the GPU, the irregularity of data access and control flow, and the complexity of programming GPUs, have presented two significant challenges to developing a programmable high-performance graph library.…

Distributed, Parallel, and Cluster Computing · Computer Science 2017-01-06 Yangzihao Wang , Yuechao Pan , Andrew Davidson , Yuduo Wu , Carl Yang , Leyuan Wang , Muhammad Osama , Chenshan Yuan , Weitang Liu , Andy T. Riffel , John D. Owens

Large language models (LLMs) show promising performance on small-scale graph reasoning tasks but fail when handling real-world graphs with complex queries. This phenomenon arises from LLMs' working memory constraints, which result in their…

Artificial Intelligence · Computer Science 2025-10-01 Rongzheng Wang , Shuang Liang , Qizhi Chen , Yihong Huang , Muquan Li , Yizhuo Ma , Dongyang Zhang , Ke Qin , Man-Fai Leung

This work presents CascadeCNN, an automated toolflow that pushes the quantisation limits of any given CNN model, aiming to perform high-throughput inference. A two-stage architecture tailored for any given CNN-FPGA pair is generated,…

Computer Vision and Pattern Recognition · Computer Science 2018-07-16 Alexandros Kouris , Stylianos I. Venieris , Christos-Savvas Bouganis

The recent explosive interest on transformers has suggested their potential to become powerful "universal" models for computer vision tasks, such as classification, detection, and segmentation. While those attempts mainly study the…

Computer Vision and Pattern Recognition · Computer Science 2021-12-10 Yifan Jiang , Shiyu Chang , Zhangyang Wang

Generative machine learning (ML) models hold great promise for accelerating materials discovery through the inverse design of inorganic crystals, enabling an unprecedented exploration of chemical space. Yet, the lack of standardized…

The rapid advancement of Large Language Models (LLMs) necessitates a deep understanding of their fundamental performance limits. This paper investigates the limits of LLM inference, focusing on hardware-imposed bottlenecks in…

Hardware Architecture · Computer Science 2025-11-17 Michael Davies , Neal Crago , Karthikeyan Sankaralingam , Christos Kozyrakis

Deep Neural Networks (DNNs) have revolutionized various fields, but their deployment on GPUs often leads to significant energy consumption. Unlike existing methods for reducing GPU energy consumption, which are either hardware-inflexible or…

Performance · Computer Science 2024-12-02 Yijia Zhang , Zhihong Gou , Shijie Cao , Weigang Feng , Sicheng Zhang , Guohao Dai , Ningyi Xu

Developing high-performance GPU kernels is critical for AI and scientific computing, but remains challenging due to its reliance on expert crafting and poor portability. While LLMs offer promise for automation, both general-purpose and…

Distributed, Parallel, and Cluster Computing · Computer Science 2025-11-26 Xinguo Zhu , Shaohui Peng , Jiaming Guo , Yunji Chen , Qi Guo , Yuanbo Wen , Hang Qin , Ruizhi Chen , Qirui Zhou , Ke Gao , Yanjun Wu , Chen Zhao , Ling Li