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As multimodal large language models (MLLMs) advance, MLLM-based virtual agents have demonstrated remarkable performance. However, existing benchmarks face significant limitations, including uncontrollable task complexity, extensive manual…

Computer Vision and Pattern Recognition · Computer Science 2025-06-11 Wendong Bu , Yang Wu , Qifan Yu , Minghe Gao , Bingchen Miao , Zhenkui Zhang , Kaihang Pan , Yunfei Li , Mengze Li , Wei Ji , Juncheng Li , Siliang Tang , Yueting Zhuang

Managing evolving graph data presents substantial challenges in storage and privacy, and training graph neural networks (GNNs) on such data often leads to catastrophic forgetting, impairing performance on earlier tasks. Despite existing…

Machine Learning · Computer Science 2025-05-29 Yinlin Zhu , Miao Hu , Di Wu

Multi-agent reinforcement learning (MARL) has been increasingly explored to learn the cooperative policy towards maximizing a certain global reward. Many existing studies take advantage of graph neural networks (GNN) in MARL to propagate…

Machine Learning · Computer Science 2020-12-25 Wenlei Shi , Xinran Wei , Jia Zhang , Xiaoyuan Ni , Arthur Jiang , Jiang Bian , Tie-Yan Liu

We propose $\textbf{MGCL}$, a model-driven graph contrastive learning (GCL) framework that leverages graphons (probabilistic generative models for graphs) to guide contrastive learning by accounting for the data's underlying generative…

Machine Learning · Computer Science 2025-06-09 Ali Azizpour , Nicolas Zilberstein , Santiago Segarra

Convolutional neural networks (CNNs) have achieved great success on grid-like data such as images, but face tremendous challenges in learning from more generic data such as graphs. In CNNs, the trainable local filters enable the automatic…

Machine Learning · Computer Science 2018-09-05 Hongyang Gao , Zhengyang Wang , Shuiwang Ji

Bilevel optimization refers to scenarios whereby the optimal solution of a lower-level energy function serves as input features to an upper-level objective of interest. These optimal features typically depend on tunable parameters of the…

Machine Learning · Computer Science 2024-03-08 Amber Yijia Zheng , Tong He , Yixuan Qiu , Minjie Wang , David Wipf

Graphs have become an important modeling tool for web applications, and Graph Neural Networks (GNNs) have achieved great success in graph representation learning. However, the performance of traditional GNNs heavily relies on a large amount…

Machine Learning · Computer Science 2024-06-05 Chenghua Gong , Xiang Li , Jianxiang Yu , Cheng Yao , Jiaqi Tan , Chengcheng Yu

Recent advances in large language models (LLMs) have led to models that tackle diverse molecular tasks, such as chemical reaction prediction and molecular property prediction. Large-scale molecular instruction-tuning datasets have enabled…

Machine Learning · Computer Science 2025-05-27 Chanhui Lee , Hanbum Ko , Yuheon Song , YongJun Jeong , Rodrigo Hormazabal , Sehui Han , Kyunghoon Bae , Sungbin Lim , Sungwoong Kim

The advent of Large Language Models (LLMs) has fundamentally reshaped the way we interact with graphs, giving rise to a new paradigm called GraphLLM. As revealed in recent studies, graph learning can benefit from LLMs. However, we observe…

Machine Learning · Computer Science 2026-04-21 Hongyu Zhan , Qixin Wang , Yusen Tan , Haitao Yu , Jingbo Zhou , Shuai Chen , Jia Li , Xiao Tan , Jun Xia

Multi-objective optimization (MOO) problems require balancing competing objectives, often under constraints. The Pareto optimal solution set defines all possible optimal trade-offs over such objectives. In this work, we present a novel…

Machine Learning · Computer Science 2022-04-19 Soumyajit Gupta , Gurpreet Singh , Raghu Bollapragada , Matthew Lease

Multi-Objective Reinforcement Learning (MORL) aims to learn a set of policies that optimize trade-offs between multiple, often conflicting objectives. MORL is computationally more complex than single-objective RL, particularly as the number…

Machine Learning · Computer Science 2026-03-27 Dimitris Michailidis , Willem Röpke , Diederik M. Roijers , Sennay Ghebreab , Fernando P. Santos

Despite significant advancements in Large Language Models (LLMs), developing advanced reasoning capabilities in LLMs remains a key challenge. Process Reward Models (PRMs) have demonstrated exceptional promise in enhancing reasoning by…

Computation and Language · Computer Science 2025-06-26 Miao Peng , Nuo Chen , Zongrui Suo , Jia Li

Large language models (LLMs) have demonstrated their strong capabilities in various domains, and have been recently integrated for graph analysis as graph language models (GLMs). With LLMs as the predictor, some GLMs can interpret unseen…

Computation and Language · Computer Science 2025-06-30 Junze Chen , Cheng Yang , Shujie Li , Zhiqiang Zhang , Yawen Li , Junping Du , Chuan Shi

Modern recommender systems aim to deeply understand users' complex preferences through their past interactions. While deep collaborative filtering approaches using Graph Neural Networks (GNNs) excel at capturing user-item relationships,…

Information Retrieval · Computer Science 2025-06-03 Yangqin Jiang , Yuhao Yang , Lianghao Xia , Da Luo , Kangyi Lin , Chao Huang

Autonomous Machine Learning Engineering (MLE) requires agents to perform sustained, iterative optimization over long horizons. While recent LLM-based agents show promise, current prompt-based agents for MLE suffer from behavioral stagnation…

Machine Learning · Computer Science 2026-05-08 Yuzhu Cai , Zexi Liu , Xinyu Zhu , Cheng Wang , Yanfeng Wang , Siheng Chen

Graph Neural Networks (GNNs) have garnered widespread attention for their potential to address the challenges posed by graph representation learning, which face complex graph-structured data across various domains. However, due to the…

Machine Learning · Computer Science 2024-08-23 Hang Gao , Jiaguo Yuan , Jiangmeng Li , Peng Qiao , Fengge Wu , Changwen Zheng , Huaping Liu

Preference-based reinforcement learning is an effective way to handle tasks where rewards are hard to specify but can be exceedingly inefficient as preference learning is often tabula rasa. We demonstrate that Large Language Models (LLMs)…

Artificial Intelligence · Computer Science 2025-04-04 Chao Yu , Qixin Tan , Hong Lu , Jiaxuan Gao , Xinting Yang , Yu Wang , Yi Wu , Eugene Vinitsky

Contrastive deep graph clustering (CDGC) leverages the power of contrastive learning to group nodes into different clusters. The quality of contrastive samples is crucial for achieving better performance, making augmentation techniques a…

Machine Learning · Computer Science 2024-08-07 Xihong Yang , Erxue Min , Ke Liang , Yue Liu , Siwei Wang , Sihang Zhou , Huijun Wu , Xinwang Liu , En Zhu

Molecular relational learning (MRL) is crucial for understanding the interaction behaviors between molecular pairs, a critical aspect of drug discovery and development. However, the large feasible model space of MRL poses significant…

Machine Learning · Computer Science 2024-10-22 Sizhe Liu , Jun Xia , Lecheng Zhang , Yuchen Liu , Yue Liu , Wenjie Du , Zhangyang Gao , Bozhen Hu , Cheng Tan , Hongxin Xiang , Stan Z. Li

Preference-based reinforcement learning (RL) offers a promising approach for aligning policies with human intent but is often constrained by the high cost of human feedback. In this work, we introduce PrefVLM, a framework that integrates…

Machine Learning · Computer Science 2025-02-04 Udita Ghosh , Dripta S. Raychaudhuri , Jiachen Li , Konstantinos Karydis , Amit Roy-Chowdhury