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Large language models (LLMs) have enabled agent-based systems that aim to automate scientific research workflows. Most existing approaches focus on fully autonomous discovery, where AI systems generate research ideas, conduct analyses, and…

Artificial Intelligence · Computer Science 2026-03-10 Chen Zhu , Xiaolu Wang

Challenges to reproducibility and replicability have gained widespread attention, driven by large replication projects with lukewarm success rates. A nascent work has emerged developing algorithms to estimate the replicability of published…

Digital Libraries · Computer Science 2024-05-06 Chuhao Wu , Tatiana Chakravorti , John Carroll , Sarah Rajtmajer

As large language models reshape scientific research, literature retrieval faces a twofold challenge: ensuring source authenticity while maintaining a deep comprehension of academic search intents. While reliable, traditional…

Information Retrieval · Computer Science 2026-05-15 Yuwen Du , Tian Jin , Jing Kang , Xianghe Pang , Jingyi Chai , Tingjia Miao , Fenyi Liu , WenHao Wang , Sikai Yao , Yuzhi Zhang , Siheng Chen

The rapid advancement in capabilities of large language models (LLMs) raises a pivotal question: How can LLMs accelerate scientific discovery? This work tackles the crucial first stage of research, generating novel hypotheses. While recent…

Artificial Intelligence · Computer Science 2025-05-27 Aniketh Garikaparthi , Manasi Patwardhan , Lovekesh Vig , Arman Cohan

While drug discovery is vital for human health, the process remains inefficient. Medicinal chemists must navigate a vast protein space to identify target proteins that meet three criteria: physical and functional interactions, therapeutic…

Scientific discovery begins with ideas, yet evaluating early-stage research concepts is a subtle and subjective human judgment. As large language models (LLMs) are increasingly tasked with generating scientific hypotheses, most systems…

Human-Computer Interaction · Computer Science 2026-03-26 Lingyu Zhang , Mitchell Wang , Boyuan Chen

Inductive reasoning is a core problem-solving capacity: humans can identify underlying principles from a few examples, which robustly generalize to novel scenarios. Recent work evaluates large language models (LLMs) on inductive reasoning…

Machine Learning · Computer Science 2024-06-03 Ruocheng Wang , Eric Zelikman , Gabriel Poesia , Yewen Pu , Nick Haber , Noah D. Goodman

Large language models (LLMs) have enabled agentic AI systems for scientific discovery, but most approaches remain limited to textbased reasoning without automated experimental verification. We propose MIND, an LLM-driven framework for…

Multiagent Systems · Computer Science 2026-04-16 Geonhee Ahn , Donghyun Lee , Hayoung Doo , Jonggeol Na , Hyunsoo Cho , Sookyung Kim

As AI-generated text enters the real-world at scale, institutions increasingly use commercial AI-text detectors, especially in education and academic-integrity workflows. We report a surprising empirical finding about such systems: when…

Computation and Language · Computer Science 2026-05-20 Yixuan Even Xu , Ziqian Zhong , Aditi Raghunathan , Fei Fang , J. Zico Kolter

The exponential growth of academic publications poses challenges for the research process, such as literature review and procedural planning. Large Language Models (LLMs) have emerged as powerful AI tools, especially when combined with…

Applied Physics · Physics 2025-02-13 Joaquin Ramirez-Medina , Mohammadmehdi Ataei , Alidad Amirfazli

Automatic test generation plays a critical role in software quality assurance. While the recent advances in Search-Based Software Testing (SBST) and Large Language Models (LLMs) have shown promise in generating useful tests, these…

Software Engineering · Computer Science 2025-07-16 Chen Yang , Junjie Chen , Bin Lin , Ziqi Wang , Jianyi Zhou

Large language models (LLMs) have shown potential in assisting scientific research, yet their ability to discover high-quality research hypotheses remains unexamined due to the lack of a dedicated benchmark. To address this gap, we…

Computation and Language · Computer Science 2026-04-21 Yujie Liu , Zonglin Yang , Tong Xie , Jinjie Ni , Ben Gao , Yuqiang Li , Shixiang Tang , Wanli Ouyang , Erik Cambria , Dongzhan Zhou

Scientific idea generation is central to discovery, requiring the joint satisfaction of novelty and scientific soundness. Unlike standard reasoning or general creative generation, scientific ideation is inherently open-ended and…

AI research agents can now generate research ideas, design experiments, run code, and draft papers, raising the possibility of large-scale AI-assisted scientific discovery. Many current agent frameworks explicitly encourage the generation…

Computation and Language · Computer Science 2026-05-28 Yixuan Tang , Yi Yang

Equipping LLM agents with reusable skills derived from past experience has become a popular and successful approach for tackling complex and long-horizon tasks. However, such lessons are often encoded as textual guidance that remains…

Artificial Intelligence · Computer Science 2026-05-19 Hongjun Liu , Yifei Ming , Shafiq Joty , Chen Zhao

Artificial intelligence (AI) models trained on published scientific findings have been used to invent valuable materials and targeted therapies, but they typically ignore the human scientists who continually alter the landscape of…

Artificial Intelligence · Computer Science 2023-06-05 Jamshid Sourati , James Evans

This paper introduces MeLA, a Metacognitive LLM-Driven Architecture that presents a new paradigm for Automatic Heuristic Design (AHD). Traditional evolutionary methods operate directly on heuristic code; in contrast, MeLA evolves the…

Artificial Intelligence · Computer Science 2025-09-08 Zishang Qiu , Xinan Chen , Long Chen , Ruibin Bai

The promise of autonomous scientific discovery (ASD) hinges not only on answering questions, but also on knowing which questions to ask. Most recent works in ASD explore the use of large language models (LLMs) in goal-driven settings,…

The cycle of scientific discovery is frequently bottlenecked by the slow, manual creation of software to support computational experiments\cite{hannay2009how}. To address this, we present Empirical Research Assistance (ERA), an AI system…

AI agents hold the potential to revolutionize scientific productivity by automating literature reviews, replicating experiments, analyzing data, and even proposing new directions of inquiry; indeed, there are now many such agents, ranging…