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Multi-agent frameworks powered by large language models (LLMs) have demonstrated great success in automated planning and task execution. However, the effective adjustment of agentic workflows during execution has not been well studied. An…

Artificial Intelligence · Computer Science 2025-02-25 Boye Niu , Yiliao Song , Kai Lian , Yifan Shen , Yu Yao , Kun Zhang , Tongliang Liu

The integration of workflows with large language models (LLMs) enables LLM-based agents to execute predefined procedures, enhancing automation in real-world applications. Traditional rule-based methods tend to limit the inherent flexibility…

Artificial Intelligence · Computer Science 2025-02-21 Yuchen Shi , Siqi Cai , Zihan Xu , Yuei Qin , Gang Li , Hang Shao , Jiawei Chen , Deqing Yang , Ke Li , Xing Sun

Retrosynthesis prediction is one of the fundamental challenges in organic synthesis. The task is to predict the reactants given a core product. With the advancement of machine learning, computer-aided synthesis planning has gained…

Chemical Physics · Physics 2022-02-01 Yue Wan , Benben Liao , Chang-Yu Hsieh , Shengyu Zhang

Language model (LM) agents deployed in novel environments often exhibit poor sample efficiency when learning from sequential interactions. This significantly hinders the usefulness of such agents in environments where interaction is costly…

Machine Learning · Computer Science 2026-01-06 Michael Y. Hu , Benjamin Van Durme , Jacob Andreas , Harsh Jhamtani

Instruction-tuned Language Models (ILMs) have become essential components of modern AI systems, demonstrating exceptional versatility across natural language and reasoning tasks. Among their most impactful applications is code generation,…

Software Engineering · Computer Science 2026-02-18 Zaiyu Cheng , Antonio Mastropaolo

Code efficiency is a fundamental aspect of software quality, yet how to harness large language models (LLMs) to optimize programs remains challenging. Prior approaches have sought for one-shot rewriting, retrieved exemplars, or prompt-based…

Software Engineering · Computer Science 2026-03-31 Zimu Wang , Yuling Shi , Mengfan Li , Zijun Liu , Jie M. Zhang , Chengcheng Wan , Xiaodong Gu

Large Language Models (LLMs) generate functionally correct solutions but often fall short in code efficiency, a critical bottleneck for real-world deployment. In this paper, we introduce a novel test-time iterative optimization framework to…

Software Engineering · Computer Science 2025-06-04 Mingzhe Du , Luu Anh Tuan , Yue Liu , Yuhao Qing , Dong Huang , Xinyi He , Qian Liu , Zejun Ma , See-kiong Ng

The emergence of large language models (LLMs) has significantly pushed the frontiers of program synthesis. Advancement of LLM-based program synthesis calls for a thorough evaluation of LLM-generated code. Most evaluation frameworks focus on…

Software Engineering · Computer Science 2025-02-20 Ruizhong Qiu , Weiliang Will Zeng , James Ezick , Christopher Lott , Hanghang Tong

LLM agents increasingly act on external systems, yet tool effects are immediate. Under failures, speculation, or contention, losing branches can leak unintended side effects with no safe rollback. We introduce Atomix, a runtime that…

Machine Learning · Computer Science 2026-02-17 Bardia Mohammadi , Nearchos Potamitis , Lars Klein , Akhil Arora , Laurent Bindschaedler

The remarkable capabilities of Large Language Model (LLM)-driven agents have enabled sophisticated systems to tackle complex, multi-step tasks, but their escalating costs threaten scalability and accessibility. This work presents the first…

Cryptic type error messages are a major obstacle to learning OCaml or other ML-based languages. In many cases, error messages cannot be interpreted without a sufficiently-precise model of the type inference algorithm. The problem of…

Programming Languages · Computer Science 2015-12-08 Arthur Charguéraud

Large Language Models (LLMs) have demonstrated profound impact on Natural Language Processing (NLP) tasks. However, their effective deployment across diverse domains often require domain-specific adaptation strategies, as generic models may…

Artificial Intelligence · Computer Science 2025-10-15 Jingyi Wang , Hongyuan Zhu , Ye Niu , Yunhui Deng

Recently, advanced large language models (LLMs) have emerged at an increasingly rapid pace. However, when faced with complex problems, most users are often unable to provide accurate and effective prompts to interact with LLMs, thus…

Computation and Language · Computer Science 2026-04-17 Wenjin Liu , Haoran Luo , Xueyuan Lin , Haoming Liu , Tiesunlong Shen , Jiapu Wang , Rui Mao , Erik Cambria

We present a machine-checked formalization of structurally governed AI workflow architectures and prove that effect-level governance can be imposed without reducing internal computational expressivity. Using Interaction Trees in Rocq 8.19,…

Artificial Intelligence · Computer Science 2026-05-27 Alan L. McCann

Large language models (LLMs) deployed as agents solve user-specified tasks over multiple steps while keeping the required manual engagement to a minimum. Crucially, such LLMs need to ground their generations in any feedback obtained to…

Computation and Language · Computer Science 2025-02-19 Jonas Gehring , Kunhao Zheng , Jade Copet , Vegard Mella , Quentin Carbonneaux , Taco Cohen , Gabriel Synnaeve

Large Language Models (LLMs) have demonstrated remarkable capabilities across various tasks, yet they face significant challenges in embodied task planning scenarios that require continuous environmental understanding and action generation.…

Computation and Language · Computer Science 2025-07-01 Zhaoye Fei , Li Ji , Siyin Wang , Junhao Shi , Jingjing Gong , Xipeng Qiu

Classification tasks play a fundamental role in various applications, spanning domains such as healthcare, natural language processing and computer vision. With the growing popularity and capacity of machine learning models, people can…

Computer Vision and Pattern Recognition · Computer Science 2025-02-26 Dujian Ding , Bicheng Xu , Laks V. S. Lakshmanan

In real world software development, improper or missing exception handling can severely impact the robustness and reliability of code. Exception handling mechanisms require developers to detect, capture, and manage exceptions according to…

Computation and Language · Computer Science 2024-12-17 Xuanming Zhang , Yuxuan Chen , Yiming Zheng , Zhexin Zhang , Yuan Yuan , Minlie Huang

The increasing size of large language models (LLMs) has led to a surge in memory requirements during training, often exceeding the capacity of high-bandwidth memory (HBM). Swap-based memory optimization incurs neither accuracy loss nor…

Distributed, Parallel, and Cluster Computing · Computer Science 2025-09-16 Zibo Wang , Yuhang Zhou , Zhibin Wang , Shipeng Li , Xinjing Huang , Chendong Cai , Bingxu Mu , Yuqing Sun , Zhiheng Hu , Bin She , Shu You , Guanghuan Fang , Rong Gu , Wanchun Dou , Guihai Chen , Chen Tian

Despite significant advancements in text generation and reasoning, Large Language Models (LLMs) still face challenges in accurately performing complex arithmetic operations. Language model systems often enable LLMs to generate code for…

Computation and Language · Computer Science 2024-09-04 Owen Dugan , Donato Manuel Jimenez Beneto , Charlotte Loh , Zhuo Chen , Rumen Dangovski , Marin Soljačić
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