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Although concept-based models promise interpretability by explaining predictions with human-understandable concepts, they typically rely on exhaustive annotations and treat concepts as flat and independent. To circumvent this, recent work…

Machine Learning · Computer Science 2026-03-12 Oscar Hill , Mateo Espinosa Zarlenga , Mateja Jamnik

Large Language Models (LLMs) have achieved significant advances in reasoning tasks. A key approach is tree-based search with verifiers, which expand candidate reasoning paths and use reward models to guide pruning and selection. Although…

Artificial Intelligence · Computer Science 2025-10-01 Yingqian Cui , Zhenwei Dai , Pengfei He , Bing He , Hui Liu , Xianfeng Tang , Jingying Zeng , Suhang Wang , Yue Xing , Jiliang Tang , Benoit Dumoulin

Retrosynthesis is the task of breaking down a chemical compound recursively step-by-step into molecular precursors until a set of commercially available molecules is found. Consequently, the goal is to provide a valid synthesis route for a…

Despite the remarkable performance of large language models (LLMs) in text-to-SQL (SQL generation), correctly producing SQL queries remains challenging during initial generation. The SQL refinement task is subsequently introduced to correct…

Computation and Language · Computer Science 2026-03-05 Zijin Hong , Hao Chen , Zheng Yuan , Qinggang Zhang , Luyao Zhuang , Qing Liao , Feiran Huang , Yangqiu Song , Xiao Huang

While large language models (LLMs) have shown promise in automating data science, existing agents often struggle with the complexity of real-world workflows that require exploring multiple sources and synthesizing open-ended insights. In…

Artificial Intelligence · Computer Science 2026-02-25 Jaehyun Nam , Jinsung Yoon , Jiefeng Chen , Raj Sinha , Jinwoo Shin , Tomas Pfister

The automation of High-Level Context (HLC) reasoning across intelligent systems at scale is imperative because of the unceasing accumulation of contextual data, the trend of the fusion of data from multiple sources (e.g., sensors,…

Artificial Intelligence · Computer Science 2024-11-11 Songhui Yue , Xiaoyan Hong , Randy K. Smith

The scalability of robotic manipulation is fundamentally bottlenecked by the scarcity of task-aligned physical interaction data. While vision-language models (VLMs) and video generation models (VGMs) hold promise for autonomous data…

Robotics · Computer Science 2026-05-14 Harold Haodong Chen , Sirui Chen , Yingjie Xu , Wenhang Ge , Ying-Cong Chen

We propose a new Verbal Reinforcement Learning (VRL) framework for interpretable task-level planning in mobile robotic systems operating under execution uncertainty. The framework follows a closed-loop architecture that enables iterative…

Multimodal Large Language Models (MLLMs) in healthcare suffer from severe confirmation bias, often hallucinating visual details to support initial, potentially erroneous diagnostic hypotheses. Existing Chain-of-Thought (CoT) approaches lack…

Computation and Language · Computer Science 2026-04-14 Zhixiang Lu , Jionglong Su

The rapid advancements in Vision Language Models (VLMs) have prompted the development of multi-modal medical assistant systems. Despite this progress, current models still have inherent probabilistic uncertainties, often producing erroneous…

Computer Vision and Pattern Recognition · Computer Science 2025-07-15 Xiao Liang , Di Wang , Zhicheng Jiao , Ronghan Li , Pengfei Yang , Quan Wang , Tat-Seng Chua

Coarse resolution, imperfect parameterizations, and uncertain initial states and forcings limit Earth-system model (ESM) predictions. Traditional bias correction via data assimilation improves constrained simulations but offers limited…

Machine Learning · Computer Science 2025-12-04 Aniruddha Bora , Shixuan Zhang , Khemraj Shukla , Bryce Harrop , George Em. Karniadakis , L. Ruby Leung

We investigate the use of an extension of rule-based modelling for cellular signalling to create a structured space of model variants. This enables the incremental development of rule sets that start from simple mechanisms and which, by a…

Other Computer Science · Computer Science 2009-11-16 Russ Harmer

Pretrained language models offer strong text understanding capabilities but remain difficult to deploy in real-world text-attributed networks due to their heavy dependence on labeled data. Meanwhile, community detection methods typically…

Machine Learning · Computer Science 2025-12-11 Hong Wang , Yinglong Zhang , Hanhan Guo , Xuewen Xia , Xing Xu

Hypothesis ranking is vital for automated scientific discovery, especially in cost-intensive, throughput-limited natural science domains. Current methods focus on pre-experiment ranking, relying solely on language model reasoning without…

Computation and Language · Computer Science 2025-10-28 Wanhao Liu , Zonglin Yang , Jue Wang , Lidong Bing , Di Zhang , Dongzhan Zhou , Yuqiang Li , Houqiang Li , Erik Cambria , Wanli Ouyang

Scientific Workflow Management Systems (SWfMSs) such as Galaxy have become essential infrastructure in bioinformatics, supporting the design, execution, and sharing of complex multi-step analyses. Despite hosting hundreds of reusable…

Software Engineering · Computer Science 2025-11-04 Shamse Tasnim Cynthia , Banani Roy

Multi-agent decision pipelines can outperform single agent workflows when complementarity holds, i.e., different agents bring unique information to the table to inform a final decision. We propose ComplLLM, a post-training framework based…

Artificial Intelligence · Computer Science 2026-02-24 Ziyang Guo , Yifan Wu , Jason Hartline , Kenneth Holstein , Jessica Hullman

Reward-model-based fine-tuning is a central paradigm in aligning Large Language Models with human preferences. However, such approaches critically rely on the assumption that proxy reward models accurately reflect intended supervision, a…

Computation and Language · Computer Science 2026-01-21 Zixuan Liu , Siavash H. Khajavi , Guangkai Jiang , Xinru Liu

Despite the great advance of Multimodal Large Language Models (MLLMs) in both instruction dataset building and benchmarking, the independence of training and evaluation makes current MLLMs hard to further improve their capability under the…

Machine Learning · Computer Science 2023-09-12 Zhiyuan Zhao , Linke Ouyang , Bin Wang , Siyuan Huang , Pan Zhang , Xiaoyi Dong , Jiaqi Wang , Conghui He

Transcending human cognitive limitations represents a critical frontier in LLM training. Proprietary agentic systems like DeepResearch have demonstrated superhuman capabilities on extremely complex information-seeking benchmarks such as…

A new formulation of Stochastic Model Predictive Output Feedback Control is presented and analyzed as a translation of Stochastic Optimal Output Feedback Control into a receding horizon setting. This requires lifting the design into a…

Optimization and Control · Mathematics 2020-05-01 Martin A Sehr , Robert R Bitmead
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