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Augmenting Large Language Models (LLMs) with retrieved external knowledge has proven effective for improving the factual accuracy of generated responses. Despite their success, retrieval-augmented LLMs still face the distractibility issue,…

Computation and Language · Computer Science 2025-02-18 Zexuan Qiu , Zijing Ou , Bin Wu , Jingjing Li , Aiwei Liu , Irwin King

Large Language Models (LLMs) have shown promise as intelligent agents in interactive decision-making tasks. Traditional approaches often depend on meticulously designed prompts, high-quality examples, or additional reward models for…

Machine Learning · Computer Science 2024-06-07 Muning Wen , Junwei Liao , Cheng Deng , Jun Wang , Weinan Zhang , Ying Wen

Reinforcement learning with verifiable rewards (RLVR) has demonstrated superior performance in enhancing the reasoning capability of large language models (LLMs). However, this accuracy-oriented learning paradigm often suffers from entropy…

Artificial Intelligence · Computer Science 2026-01-19 Hongye Cao , Zhixin Bai , Ziyue Peng , Boyan Wang , Tianpei Yang , Jing Huo , Yuyao Zhang , Yang Gao

Decoding strategies play a central role in shaping the reasoning ability of large language models (LLMs). Traditional methods such as greedy decoding and beam search often suffer from error propagation, while sampling-based approaches…

Large language models (LLMs) have shown promise in performing complex multi-step reasoning, yet they continue to struggle with mathematical reasoning, often making systematic errors. A promising solution is reinforcement learning (RL)…

Machine Learning · Computer Science 2025-09-22 Hanning Zhang , Pengcheng Wang , Shizhe Diao , Yong Lin , Rui Pan , Hanze Dong , Dylan Zhang , Pavlo Molchanov , Tong Zhang

Large language models (LLMs) augmented with multi-step reasoning and action generation abilities have shown promise in leveraging external tools to tackle complex tasks that require long-horizon planning. However, existing approaches either…

Artificial Intelligence · Computer Science 2025-10-16 Wei Fan , Wenlin Yao , Zheng Li , Feng Yao , Xin Liu , Liang Qiu , Qingyu Yin , Yangqiu Song , Bing Yin

Large language models (LLMs) achieve remarkable generative performance, yet their output quality is dependent on the decoding strategy. While sampling-based methods (e.g., top-k, nucleus) and search-and-select based methods (e.g., beam…

Machine Learning · Computer Science 2026-05-12 Benjamin Patrick Evans , Sumitra Ganesh , Leo Ardon

Enhancement reports (ERs) serve as a critical communication channel between users and developers, capturing valuable suggestions for software improvement. However, manually processing these reports is resource-intensive, leading to delays…

Software Engineering · Computer Science 2025-06-19 Haosheng Zuo , Feifei Niu , Chuanyi Li

Reasoning ability has become a defining capability of Large Language Models (LLMs), with Reinforcement Learning with Verifiable Rewards (RLVR) emerging as a key paradigm to enhance it. However, RLVR training often suffers from policy…

Machine Learning · Computer Science 2026-04-20 Xiaoyun Zhang , Xiaojian Yuan , Di Huang , Wang You , Chen Hu , Jingqing Ruan , Ai Jian , Kejiang Chen , Xing Hu

Large language models (LLMs) exhibit impressive natural language capabilities but suffer from hallucination -- generating content ungrounded in the realities of training data. Recent work has focused on decoding techniques to improve…

Computation and Language · Computer Science 2024-04-16 Souvik Das , Lifeng Jin , Linfeng Song , Haitao Mi , Baolin Peng , Dong Yu

Recent advances in reinforcement learning (RL) have improved the reasoning capabilities of large language models (LLMs) and vision-language models (VLMs). However, the widely used Group Relative Policy Optimization (GRPO) consistently…

Artificial Intelligence · Computer Science 2026-04-20 Chen Wang , Lai Wei , Yanzhi Zhang , Chenyang Shao , Zedong Dan , Weiran Huang , Ge Lan , Yue Wang

Recently, reinforcement learning with verifiable rewards (RLVR) has been widely used for enhancing the reasoning abilities of large language models (LLMs). A core challenge in RLVR involves managing the exchange between entropy and…

Computation and Language · Computer Science 2025-08-05 Jia Deng , Jie Chen , Zhipeng Chen , Wayne Xin Zhao , Ji-Rong Wen

Recent advances in large language models (LLMs) have demonstrated significant potential in hardware design automation, particularly in using natural language to synthesize Register-Transfer Level (RTL) code. Despite this progress, a gap…

Machine Learning · Computer Science 2026-02-26 Jiahe Shi , Zhengqi Gao , Ching-Yun Ko , Duane Boning

Finetuning a Large Language Model (LLM) is crucial for generating results towards specific objectives. This research delves into the realm of drug optimization and introduce a novel reinforcement learning algorithm to finetune a drug…

Machine Learning · Computer Science 2025-02-12 Xuefeng Liu , Songhao Jiang , Siyu Chen , Zhuoran Yang , Yuxin Chen , Ian Foster , Rick Stevens

Large Language Models (LLMs) possess strong representation and reasoning capabilities, but their application to structure-based drug design (SBDD) is limited by insufficient understanding of protein structures and unpredictable molecular…

Machine Learning · Computer Science 2026-01-27 Xuanning Hu , Anchen Li , Qianli Xing , Jinglong Ji , Hao Tuo , Bo Yang

The effective training of Large Language Models (LLMs) for function calling faces a critical challenge: balancing exploration of complex reasoning paths with stable policy optimization. Standard methods like Supervised Fine-Tuning (SFT)…

Speculative decoding (SD) accelerates large language model (LLM) reasoning by using a small draft model to generate candidate tokens, which the target LLM either accepts directly or regenerates upon rejection. However, excessive alignment…

Computation and Language · Computer Science 2026-01-01 Tiancheng Su , Meicong Zhang , Guoxiu He

In long-horizon tasks, recent agents based on Large Language Models (LLMs) face a significant challenge that sparse, outcome-based rewards make it difficult to assign credit to intermediate steps. Previous methods mainly focus on creating…

Machine Learning · Computer Science 2025-09-12 Jiawei Wang , Jiacai Liu , Yuqian Fu , Yingru Li , Xintao Wang , Yuan Lin , Yu Yue , Lin Zhang , Yang Wang , Ke Wang

Reinforcement learning (RL) over text representations can be effective for finding high-value policies that can search over graphs. However, RL requires careful structuring of the search space and algorithm design to be effective in this…

Machine Learning · Computer Science 2023-10-05 Raj Ghugare , Santiago Miret , Adriana Hugessen , Mariano Phielipp , Glen Berseth

Molecular discovery, when formulated as an optimization problem, presents significant computational challenges because optimization objectives can be non-differentiable. Evolutionary Algorithms (EAs), often used to optimize black-box…

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