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Safe deployment of large language models (LLMs) may benefit from a reliable method for assessing their generated content to determine when to abstain or to selectively generate. While likelihood-based metrics such as perplexity are widely…

Computation and Language · Computer Science 2023-12-18 Jie Ren , Yao Zhao , Tu Vu , Peter J. Liu , Balaji Lakshminarayanan

Important tasks such as reasoning and planning are fundamentally algorithmic, meaning that solving them robustly requires acquiring true reasoning or planning algorithms, rather than shortcuts. Large Language Models lack true algorithmic…

Artificial Intelligence · Computer Science 2025-05-27 Lucas Saldyt , Subbarao Kambhampati

Large language models (LLMs) are introducing a paradigm shift in molecular discovery by enabling text-guided interaction with chemical spaces through natural language, symbolic notations, with emerging extensions to incorporate multi-modal…

Machine Learning · Computer Science 2025-05-23 Ziqing Wang , Kexin Zhang , Zihan Zhao , Yibo Wen , Abhishek Pandey , Han Liu , Kaize Ding

The acceleration of Large Language Models (LLMs) research has opened up new possibilities for evaluating generated texts. They serve as scalable and economical evaluators, but the question of how reliable these evaluators are has emerged as…

Computation and Language · Computer Science 2024-12-10 Minzhi Li , Zhengyuan Liu , Shumin Deng , Shafiq Joty , Nancy F. Chen , Min-Yen Kan

As intelligent systems become more autonomous, the scientific community focuses on creating decision-making mechanisms that include ethical and moral considerations, unlike traditional utility-maximisation models. To achieve this, a key…

Artificial Intelligence · Computer Science 2026-05-28 Eduardo de la Cruz Fernández , Marcelo Karanik , Sascha Ossowski

Causality is essential for understanding complex systems, such as the economy, the brain, and the climate. Constructing causal graphs often relies on either data-driven or expert-driven approaches, both fraught with challenges. The former…

Artificial Intelligence · Computer Science 2024-06-12 Kai-Hendrik Cohrs , Gherardo Varando , Emiliano Diaz , Vasileios Sitokonstantinou , Gustau Camps-Valls

Lately, instruction-based techniques have made significant strides in improving performance in few-shot learning scenarios. They achieve this by bridging the gap between pre-trained language models and fine-tuning for specific downstream…

Information Retrieval · Computer Science 2024-01-25 Hiranmai Sri Adibhatla , Pavan Baswani , Manish Shrivastava

Large Language Models (LLMs) excel in various tasks, but they rely on carefully crafted prompts that often demand substantial human effort. To automate this process, in this paper, we propose a novel framework for discrete prompt…

Computation and Language · Computer Science 2025-05-02 Qingyan Guo , Rui Wang , Junliang Guo , Bei Li , Kaitao Song , Xu Tan , Guoqing Liu , Jiang Bian , Yujiu Yang

In this work, we unveil and study idiosyncrasies in Large Language Models (LLMs) -- unique patterns in their outputs that can be used to distinguish the models. To do so, we consider a simple classification task: given a particular text…

Computation and Language · Computer Science 2025-06-17 Mingjie Sun , Yida Yin , Zhiqiu Xu , J. Zico Kolter , Zhuang Liu

Assessing the quality of scientific research is essential for scholarly communication, yet widely used approaches face limitations in scalability, subjectivity, and time delay. Recent advances in large language models (LLMs) offer new…

Information Retrieval · Computer Science 2026-04-21 Mengjia Wu , Yi Zhang , Robin Haunschild , Lutz Bornmann

This paper investigates the capabilities of large language models (LLMs) in formulating and solving decision-making problems using mathematical programming. We first conduct a systematic review and meta-analysis of recent literature to…

Artificial Intelligence · Computer Science 2025-08-26 Mohammad J. Abdel-Rahman , Yasmeen Alslman , Dania Refai , Amro Saleh , Malik A. Abu Loha , Mohammad Yahya Hamed

Large Language Models (LLMs) are catalyzing a paradigm shift in scientific discovery, evolving from task-specific automation tools into increasingly autonomous agents and fundamentally redefining research processes and human-AI…

Computation and Language · Computer Science 2025-09-18 Tianshi Zheng , Zheye Deng , Hong Ting Tsang , Weiqi Wang , Jiaxin Bai , Zihao Wang , Yangqiu Song

Problem-solving has been a fundamental driver of human progress in numerous domains. With advancements in artificial intelligence, Large Language Models (LLMs) have emerged as powerful tools capable of tackling complex problems across…

Machine Learning · Computer Science 2025-05-07 Da Zheng , Lun Du , Junwei Su , Yuchen Tian , Yuqi Zhu , Jintian Zhang , Lanning Wei , Ningyu Zhang , Huajun Chen

Large-language models (LLMs) can support a wide range of applications like conversational agents, creative writing or general query answering. However, they are ill-suited for query answering in high-stake domains like medicine because they…

Computation and Language · Computer Science 2024-02-09 Nico Potyka , Yuqicheng Zhu , Yunjie He , Evgeny Kharlamov , Steffen Staab

With the exponential increase in online scientific literature, identifying reliable domain-specific data has become increasingly important but also very challenging. Manual data collection and filtering for domain-specific scientific…

Information Retrieval · Computer Science 2026-03-10 Nikita Gautam , Doina Caragea , Ignacio Ciampitti , Federico Gomez

Cognitive systems generally require a human to translate a problem definition into some specification that the cognitive system can use to attempt to solve the problem or perform the task. In this paper, we illustrate that large language…

Artificial Intelligence · Computer Science 2024-06-12 Robert E. Wray , James R. Kirk , John E. Laird

This study explores the explainability capabilities of large language models (LLMs), when employed to autonomously generate machine learning (ML) solutions. We examine two classification tasks: (i) a binary classification problem focused on…

Large language models (LLMs) are becoming increasingly better at a wide range of Natural Language Processing tasks (NLP), such as text generation and understanding. Recently, these models have extended their capabilities to coding tasks,…

Machine Learning · Computer Science 2024-10-23 Nishat Raihan , Mohammed Latif Siddiq , Joanna C. S. Santos , Marcos Zampieri

This study presents a multimodal AI framework designed for precisely classifying medical diagnostic images. Utilizing publicly available datasets, the proposed system compares the strengths of convolutional neural networks (CNNs) and…

Image and Video Processing · Electrical Eng. & Systems 2025-06-04 Shibbir Ahmed , Shahnewaz Karim Sakib , Anindya Bijoy Das

Graph plays a significant role in representing and analyzing complex relationships in real-world applications such as citation networks, social networks, and biological data. Recently, Large Language Models (LLMs), which have achieved…

Machine Learning · Computer Science 2024-04-25 Yuhan Li , Zhixun Li , Peisong Wang , Jia Li , Xiangguo Sun , Hong Cheng , Jeffrey Xu Yu