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Predicting chemical reactions, a fundamental challenge in chemistry, involves forecasting the resulting products from a given reaction process. Conventional techniques, notably those employing Graph Neural Networks (GNNs), are often limited…

Machine Learning · Computer Science 2023-10-23 Yaorui Shi , An Zhang , Enzhi Zhang , Zhiyuan Liu , Xiang Wang

Graph representation learning methods are highly effective in handling complex non-Euclidean data by capturing intricate relationships and features within graph structures. However, traditional methods face challenges when dealing with…

Machine Learning · Computer Science 2025-02-25 Hang Gao , Chenhao Zhang , Fengge Wu , Junsuo Zhao , Changwen Zheng , Huaping Liu

Scaling deep learning models has been at the heart of recent revolutions in language modelling and image generation. Practitioners have observed a strong relationship between model size, dataset size, and performance. However,…

Graph neural networks (GNNs) have attracted increasing interests. With broad deployments of GNNs in real-world applications, there is an urgent need for understanding the robustness of GNNs under adversarial attacks, especially in realistic…

Machine Learning · Computer Science 2021-06-22 Jiaqi Ma , Junwei Deng , Qiaozhu Mei

Large Language Models (LLMs) exhibit strong reasoning capabilities on structured tasks, yet the internal mechanisms underlying such behaviors remain poorly understood. Existing interpretation methods mainly focus on token-level…

Computation and Language · Computer Science 2026-02-02 Xinnan Dai , Xianxuan Long , Chung-Hsiang Lo , Kai Guo , Shenglai Zeng , Dongsheng Luo , Jiliang Tang

A plethora of jailbreaking attacks have been proposed to obtain harmful responses from safety-tuned LLMs. These methods largely succeed in coercing the target output in their original settings, but their attacks vary substantially in…

Machine Learning · Computer Science 2025-06-12 Valentyn Boreiko , Alexander Panfilov , Vaclav Voracek , Matthias Hein , Jonas Geiping

Large Language Models (LLMs) have demonstrated exceptional proficiency in instruction-following, becoming increasingly crucial across various applications. However, this capability brings with it the risk of prompt injection attacks, where…

Computation and Language · Computer Science 2023-11-28 Zekun Li , Baolin Peng , Pengcheng He , Xifeng Yan

Large language models (LLMs) and LLM-based agents have been widely deployed in a wide range of applications in the real world, including healthcare diagnostics, financial analysis, customer support, robotics, and autonomous driving,…

Cryptography and Security · Computer Science 2025-05-20 Wenrui Xu , Keshab K. Parhi

The advent of Large Language Models (LLMs) has revolutionized various applications by providing advanced natural language processing capabilities. However, this innovation introduces new cybersecurity challenges. This paper explores the…

Cryptography and Security · Computer Science 2024-06-18 Stephen Burabari Tete

Large Language Models (LLMs) have achieved impressive performance in text understanding and have become an essential tool for building smart assistants. Originally focusing on text, they have been enhanced with multimodal capabilities in…

Software Engineering · Computer Science 2024-10-24 Aaron Haag , Vlad Argatu , Oliver Lohse

Graph-based personality detection constructs graph structures from textual data, particularly social media posts. Current methods often struggle with sparse or noisy data and rely on static graphs, limiting their ability to capture dynamic…

Computation and Language · Computer Science 2025-04-04 Lingzhi Shen , Yunfei Long , Xiaohao Cai , Guanming Chen , Yuhan Wang , Imran Razzak , Shoaib Jameel

Large language models (LLMs), such as GPT4 and LLaMA, are creating significant advancements in natural language processing, due to their strong text encoding/decoding ability and newly found emergent capability (e.g., reasoning). While LLMs…

Computation and Language · Computer Science 2024-11-22 Bowen Jin , Gang Liu , Chi Han , Meng Jiang , Heng Ji , Jiawei Han

While graph neural networks (GNNs) have shown remarkable performance across diverse graph-related tasks, their high-dimensional hidden representations render them black boxes. In this work, we propose Graph Lingual Network (GLN), a GNN…

Machine Learning · Computer Science 2025-09-16 Sunwoo Kim , Soo Yong Lee , Jaemin Yoo , Kijung Shin

Large language models (LLMs) have achieved remarkable success due to their exceptional generative capabilities. Despite their success, they also have inherent limitations such as a lack of up-to-date knowledge and hallucination.…

Cryptography and Security · Computer Science 2024-08-14 Wei Zou , Runpeng Geng , Binghui Wang , Jinyuan Jia

Narrative data spans all disciplines and provides a coherent model of the world to the reader or viewer. Recent advancement in machine learning and Large Language Models (LLMs) have enable great strides in analyzing natural language.…

Large Language Models (LLMs) demonstrate impressive capabilities across various fields, yet their increasing use raises critical security concerns. This article reviews recent literature addressing key issues in LLM security, with a focus…

Cryptography and Security · Computer Science 2025-11-26 Benji Peng , Keyu Chen , Ming Li , Pohsun Feng , Ziqian Bi , Junyu Liu , Xinyuan Song , Qian Niu

Large Language Models (LLMs), which bridge the gap between human language understanding and complex problem-solving, achieve state-of-the-art performance on several NLP tasks, particularly in few-shot and zero-shot settings. Despite the…

Cryptography and Security · Computer Science 2025-01-07 Shuai Zhao , Meihuizi Jia , Zhongliang Guo , Leilei Gan , Xiaoyu Xu , Xiaobao Wu , Jie Fu , Yichao Feng , Fengjun Pan , Luu Anh Tuan

Deep neural networks (DNNs) have achieved significant performance in various tasks. However, recent studies have shown that DNNs can be easily fooled by small perturbation on the input, called adversarial attacks. As the extensions of DNNs…

Machine Learning · Computer Science 2020-12-15 Wei Jin , Yaxin Li , Han Xu , Yiqi Wang , Shuiwang Ji , Charu Aggarwal , Jiliang Tang

Large Language Models (LLMs) have emerged as powerful tools for automating programming tasks, including security-related ones. However, they can also introduce vulnerabilities during code generation, fail to detect existing vulnerabilities,…

Cryptography and Security · Computer Science 2026-03-18 Enna Basic , Alberto Giaretta

Explaining Graph Neural Network (XGNN) has gained growing attention to facilitate the trust of using GNNs, which is the mainstream method to learn graph data. Despite their growing attention, Existing XGNNs focus on improving the…

Cryptography and Security · Computer Science 2025-02-07 Jiate Li , Meng Pang , Yun Dong , Jinyuan Jia , Binghui Wang
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