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Anomaly detection (AD) is essential in areas such as fraud detection, network monitoring, and scientific research. However, the diversity of data modalities and the increasing number of specialized AD libraries pose challenges for…

Computation and Language · Computer Science 2025-05-20 Tiankai Yang , Junjun Liu , Wingchun Siu , Jiahang Wang , Zhuangzhuang Qian , Chanjuan Song , Cheng Cheng , Xiyang Hu , Yue Zhao

Drug discovery frequently loses momentum when data, expertise, and tools are scattered, slowing design cycles. To shorten this loop we built a hierarchical, tool using agent framework that automates molecular optimisation. A Principal…

Machine Learning · Computer Science 2025-08-06 Atabey Ünlü , Phil Rohr , Ahmet Celebi

The push to compress and impart the proficiency of Large Language Models (LLMs) into more deployable and efficient Small Language Models (SLMs) has benefited from improvements in knowledge distillation (KD) techniques. These techniques…

Artificial Intelligence · Computer Science 2025-07-02 Shreyansh Padarha

In this paper we introduce ResearchCodeAgent, a novel multi-agent system leveraging large language models (LLMs) agents to automate the codification of research methodologies described in machine learning literature. The system bridges the…

Software Engineering · Computer Science 2025-05-06 Shubham Gandhi , Dhruv Shah , Manasi Patwardhan , Lovekesh Vig , Gautam Shroff

AI agents increasingly excel at generating, testing, and refining code. However, they fall short on tasks requiring formal guarantees of full coverage that testing alone cannot provide. Distributed systems are a prime example: properties…

In the era of Big Code, when researchers seek to study an increasingly large number of repositories to support their findings, the data processing stage may require manipulating millions and more of records. In this work we focus on studies…

Software Engineering · Computer Science 2019-10-22 Stanislav Levin , Amiram Yehudai

Pre-trained language models (PLMs) have emerged as powerful tools for code understanding. However, deploying these PLMs in large-scale applications faces practical challenges due to their computational intensity and inference latency.…

Software Engineering · Computer Science 2025-08-22 Ruiqi Wang , Zezhou Yang , Cuiyun Gao , Xin Xia , Qing Liao

Can a large language model (LLM) improve at code generation using only its own raw outputs, without a verifier, a teacher model, or reinforcement learning? We answer in the affirmative with simple self-distillation (SSD): sample solutions…

Computation and Language · Computer Science 2026-04-02 Ruixiang Zhang , Richard He Bai , Huangjie Zheng , Navdeep Jaitly , Ronan Collobert , Yizhe Zhang

Autoresearch offers a flexible paradigm for automating scientific tasks, in which an AI agent proposes, implements, evaluates, and refines candidate solutions against a quantitative objective. Here, we use composition-based…

Materials Science · Physics 2026-05-15 Matteo Cobelli , Stefano Sanvito

In this paper, we present AgentDisCo, a novel Disentangled and Collaborative agentic architecture that formulates deep research as an adversarial optimization problem between information exploration and exploitation. Unlike existing…

Information Retrieval · Computer Science 2026-05-13 Jiarui Jin , Zexuan Yan , Shijian Wang , Wenxiang Jiao , Yuan Lu

Corpus distillation for biomedical large language models (LLMs) seeks to address the pressing challenge of insufficient quantity and quality in open-source annotated scientific corpora, which remains a bottleneck for effective LLM training…

Computation and Language · Computer Science 2025-12-19 Meng Xiao , Xunxin Cai , Qingqing Long , Chengrui Wang , Yuanchun Zhou , Hengshu Zhu

Recent progress in autonomous code generation has fueled excitement around AI agents capable of accelerating scientific discovery by running experiments. However, there is currently no benchmark that evaluates whether such agents can…

Artificial Intelligence · Computer Science 2025-06-25 Gyeongwon James Kim , Alex Wilf , Louis-Philippe Morency , Daniel Fried

Knowledge distillation (KD) methods compress large models into smaller students with manually-designed student architectures given pre-specified computational cost. This requires several trials to find a viable student, and further…

Computation and Language · Computer Science 2022-02-22 Dongkuan Xu , Subhabrata Mukherjee , Xiaodong Liu , Debadeepta Dey , Wenhui Wang , Xiang Zhang , Ahmed Hassan Awadallah , Jianfeng Gao

Large Language Model (LLM)-based agent systems are increasingly used for scientific tasks, yet their practical capability remains constrained by the narrow scope of manually curated tools they can invoke. Much scientific computational…

Software Engineering · Computer Science 2026-05-11 Shimin Di , Xujie Yuan , Hanghui Guo , Chaoqian Ouyang , Yongxu Liu , Ling Yue , Zhangze Chen , Libin Zheng , Jia Zhu , Shaowu Pan , Jian Yin , Yong Rui , Min-Ling Zhang

Large Language Models (LLMs) have made significant strides in code generation and problem solving. Current approaches employ external tool-based iterative debuggers that use compiler or other tool-based runtime feedback to refine coarse…

Computation and Language · Computer Science 2026-04-28 Md. Ashraful Islam , Mohammed Eunus Ali , Md Rizwan Parvez

Before developing a new mobile app, the development team usually endeavors painstaking efforts to review many existing apps with similar purposes. The review process is crucial in the sense that it reduces market risks and provides…

Software Engineering · Computer Science 2022-03-15 Sen Chen , Lingling Fan , Chunyang Chen , Yang Liu

Historically, scientific discovery has been a lengthy and costly process, demanding substantial time and resources from initial conception to final results. To accelerate scientific discovery, reduce research costs, and improve research…

Human-Computer Interaction · Computer Science 2025-06-18 Samuel Schmidgall , Yusheng Su , Ze Wang , Ximeng Sun , Jialian Wu , Xiaodong Yu , Jiang Liu , Michael Moor , Zicheng Liu , Emad Barsoum

Coding agents produce rich trajectories while solving software-engineering tasks. To enable agent self-evolution, these trajectories can be distilled into reusable procedural skills that compactly encode experience to guide future behavior.…

Artificial Intelligence · Computer Science 2026-05-26 Yanzhou Li , Yiran Zhang , Xiaoyu Zhang , Xiaoxia Liu , Yang Liu

In this paper, we study a sequential decision-making problem, called Adaptive Sampling for Discovery (ASD). Starting with a large unlabeled dataset, algorithms for ASD adaptively label the points with the goal to maximize the sum of…

Machine Learning · Statistics 2023-01-04 Ziping Xu , Eunjae Shim , Ambuj Tewari , Paul Zimmerman

Coding agents powered by large language models (LLMs) have gained traction for automating code generation through iterative problem-solving with minimal human involvement. Despite the emergence of various frameworks, e.g., LangChain,…

Machine Learning · Computer Science 2025-08-19 Junpeng Wang , Yuzhong Chen , Menghai Pan , Chin-Chia Michael Yeh , Mahashweta Das