Yiqi Wang

Hongzhi Wen, Jiayuan Ding, Wei Jin et al.

Recent advances in multimodal single-cell technologies have enabled simultaneous acquisitions of multiple omics data from the same cell, providing deeper insights into cellular states and dynamics. However, it is challenging to learn the joint representations from the multimodal data, model the relationship between modalities, and, more importantly, incorporate the vast amount of single-modality datasets into the downstream analyses. To address these challenges and correspondingly facilitate multimodal single-cell data analyses, three key tasks have been introduced: $\textit{modality prediction}$, $\textit{modality matching}$ and $\textit{joint embedding}$. In this work, we present a general Graph Neural Network framework $\textit{scMoGNN}$ to tackle these three tasks and show that $\textit{scMoGNN}$ demonstrates superior results in all three tasks compared with the state-of-the-art and conventional approaches. Our method is an official winner in the overall ranking of $\textit{Modality prediction}$ from NeurIPS 2021 Competition, and all implementations of our methods have been integrated into DANCE package~\url{https://github.com/OmicsML/dance}.

Mengyang Ma, Xiaopeng Li, Wanyu Wang et al.

Transformer structures have been widely used in sequential recommender systems (SRS). However, as user interaction histories increase, computational time and memory requirements also grow. This is mainly caused by the standard attention mechanism. Although there exist many methods employing efficient attention and SSM-based models, these approaches struggle to effectively model long sequences and may exhibit unstable performance on short sequences. To address these challenges, we design a sparse attention mechanism, BlossomRec, which models both long-term and short-term user interests through attention computation to achieve stable performance across sequences of varying lengths. Specifically, we categorize user interests in recommendation systems into long-term and short-term interests, and compute them using two distinct sparse attention patterns, with the results combined through a learnable gated output. Theoretically, it significantly reduces the number of interactions participating in attention computation. Extensive experiments on four public datasets demonstrate that BlossomRec, when integrated with state-of-the-art Transformer-based models, achieves comparable or even superior performance while significantly reducing memory usage, providing strong evidence of BlossomRec's efficiency and effectiveness. The code is available at https://github.com/Applied-Machine-Learning-Lab/WWW2026_BlossomRec.

Juanhui Li, Harry Shomer, Jiayuan Ding et al.

Knowledge graphs (KGs) facilitate a wide variety of applications. Despite great efforts in creation and maintenance, even the largest KGs are far from complete. Hence, KG completion (KGC) has become one of the most crucial tasks for KG research. Recently, considerable literature in this space has centered around the use of Message Passing (Graph) Neural Networks (MPNNs), to learn powerful embeddings. The success of these methods is naturally attributed to the use of MPNNs over simpler multi-layer perceptron (MLP) models, given their additional message passing (MP) component. In this work, we find that surprisingly, simple MLP models are able to achieve comparable performance to MPNNs, suggesting that MP may not be as crucial as previously believed. With further exploration, we show careful scoring function and loss function design has a much stronger influence on KGC model performance. This suggests a conflation of scoring function design, loss function design, and MP in prior work, with promising insights regarding the scalability of state-of-the-art KGC methods today, as well as careful attention to more suitable MP designs for KGC tasks tomorrow. Our codes are publicly available at: https://github.com/Juanhui28/Are_MPNNs_helpful.

Xihong Yang, Yiqi Wang, Yue Liu et al.

Graph Neural Networks (GNNs) have achieved promising performance in semi-supervised node classification in recent years. However, the problem of insufficient supervision, together with representation collapse, largely limits the performance of the GNNs in this field. To alleviate the collapse of node representations in semi-supervised scenario, we propose a novel graph contrastive learning method, termed Mixed Graph Contrastive Network (MGCN). In our method, we improve the discriminative capability of the latent embeddings by an interpolation-based augmentation strategy and a correlation reduction mechanism. Specifically, we first conduct the interpolation-based augmentation in the latent space and then force the prediction model to change linearly between samples. Second, we enable the learned network to tell apart samples across two interpolation-perturbed views through forcing the correlation matrix across views to approximate an identity matrix. By combining the two settings, we extract rich supervision information from both the abundant unlabeled nodes and the rare yet valuable labeled nodes for discriminative representation learning. Extensive experimental results on six datasets demonstrate the effectiveness and the generality of MGCN compared to the existing state-of-the-art methods. The code of MGCN is available at https://github.com/xihongyang1999/MGCN on Github.

Zihuai Zhao, Wenqi Fan, Jiatong Li et al.

With the prosperity of e-commerce and web applications, Recommender Systems (RecSys) have become an important component of our daily life, providing personalized suggestions that cater to user preferences. While Deep Neural Networks (DNNs) have made significant advancements in enhancing recommender systems by modeling user-item interactions and incorporating textual side information, DNN-based methods still face limitations, such as difficulties in understanding users' interests and capturing textual side information, inabilities in generalizing to various recommendation scenarios and reasoning on their predictions, etc. Meanwhile, the emergence of Large Language Models (LLMs), such as ChatGPT and GPT4, has revolutionized the fields of Natural Language Processing (NLP) and Artificial Intelligence (AI), due to their remarkable abilities in fundamental responsibilities of language understanding and generation, as well as impressive generalization and reasoning capabilities. As a result, recent studies have attempted to harness the power of LLMs to enhance recommender systems. Given the rapid evolution of this research direction in recommender systems, there is a pressing need for a systematic overview that summarizes existing LLM-empowered recommender systems, to provide researchers in relevant fields with an in-depth understanding. Therefore, in this paper, we conduct a comprehensive review of LLM-empowered recommender systems from various aspects including Pre-training, Fine-tuning, and Prompting. More specifically, we first introduce representative methods to harness the power of LLMs (as a feature encoder) for learning representations of users and items. Then, we review recent techniques of LLMs for enhancing recommender systems from three paradigms, namely pre-training, fine-tuning, and prompting. Finally, we comprehensively discuss future directions in this emerging field.

Xiaotian Han, Yiren Jian, Xuefeng Hu et al.

Pre-training on large-scale, high-quality datasets is crucial for enhancing the reasoning capabilities of Large Language Models (LLMs), especially in specialized domains such as mathematics. Despite the recognized importance, the Multimodal LLMs (MLLMs) field currently lacks a comprehensive open-source pre-training dataset specifically designed for mathematical reasoning. To address this gap, we introduce InfiMM-WebMath-40B, a high-quality dataset of interleaved image-text documents. It comprises 24 million web pages, 85 million associated image URLs, and 40 billion text tokens, all meticulously extracted and filtered from CommonCrawl. We provide a detailed overview of our data collection and processing pipeline. To demonstrate the robustness of InfiMM-WebMath-40B, we conducted evaluations in both text-only and multimodal settings. Our evaluations on text-only benchmarks show that, despite utilizing only 40 billion tokens, our dataset significantly enhances the performance of our 1.3B model, delivering results comparable to DeepSeekMath-1.3B, which uses 120 billion tokens for the same model size. Nevertheless, with the introduction of our multi-modal math pre-training dataset, our models set a new state-of-the-art among open-source models on multi-modal math benchmarks such as MathVerse and We-Math. We release our data at https://huggingface.co/datasets/Infi-MM/InfiMM-WebMath-40B.

Zijian Zhang, Xiangyu Zhao, Qidong Liu et al.

In the era of information explosion, spatio-temporal data mining serves as a critical part of urban management. Considering the various fields demanding attention, e.g., traffic state, human activity, and social event, predicting multiple spatio-temporal attributes simultaneously can alleviate regulatory pressure and foster smart city construction. However, current research can not handle the spatio-temporal multi-attribute prediction well due to the complex relationships between diverse attributes. The key challenge lies in how to address the common spatio-temporal patterns while tackling their distinctions. In this paper, we propose an effective solution for spatio-temporal multi-attribute prediction, PromptST. We devise a spatio-temporal transformer and a parameter-sharing training scheme to address the common knowledge among different spatio-temporal attributes. Then, we elaborate a spatio-temporal prompt tuning strategy to fit the specific attributes in a lightweight manner. Through the pretrain and prompt tuning phases, our PromptST is able to enhance the specific spatio-temoral characteristic capture by prompting the backbone model to fit the specific target attribute while maintaining the learned common knowledge. Extensive experiments on real-world datasets verify that our PromptST attains state-of-the-art performance. Furthermore, we also prove PromptST owns good transferability on unseen spatio-temporal attributes, which brings promising application potential in urban computing. The implementation code is available to ease reproducibility.

Yiqi Wang, Jiaqi Zhang, Taotao Cai et al.

Large language model (LLM)-based agents increasingly solve complex tasks by interacting with external tools, retrieval systems, memory modules, environments, and other agents. These capabilities expand agent autonomy, but also make agent behavior harder to verify, debug, and audit. Final-answer accuracy alone cannot explain how an output was produced, which evidence supported each claim, whether tool calls were justified, how memory influenced later decisions, or where execution failures originated. Evidence tracing and execution provenance address this gap by modeling how retrieved evidence, tool outputs, memory items, environment observations, intermediate claims, actions, and final answers are connected throughout agent execution. This survey provides a systematic review and conceptual framework for evidence tracing and execution provenance in LLM agents. We organize related work around a unified provenance perspective that connects retrieval grounding, claim support, tool-use safety, memory lineage, observability, debugging, audit, and recovery. We introduce a taxonomy covering trace sources, evidence and execution units, provenance relations, tracing granularity and timing, representation forms, and trust functions. We review key methodological directions, including provenance representation, evidence attribution, tool-use provenance, runtime guardrails, provenance-bearing memory, trace-based observability, and failure diagnosis. We also map existing benchmarks, datasets, and evaluation metrics to provenance-related capabilities, and discuss how evaluation can move from final-answer correctness toward process-level accountability. Finally, we outline open challenges, including unified trace schemas, claim-level and semantic provenance, provenance-aware safety mechanisms, realistic execution-trace benchmarks, recovery-oriented evaluation, and privacy-aware audit infrastructure.

Yiqi Wang, Chaozhuo Li, Wei Jin et al.

Graph Neural Networks (GNNs) have made tremendous progress in the graph classification task. However, a performance gap between the training set and the test set has often been noticed. To bridge such gap, in this work we introduce the first test-time training framework for GNNs to enhance the model generalization capacity for the graph classification task. In particular, we design a novel test-time training strategy with self-supervised learning to adjust the GNN model for each test graph sample. Experiments on the benchmark datasets have demonstrated the effectiveness of the proposed framework, especially when there are distribution shifts between training set and test set. We have also conducted exploratory studies and theoretical analysis to gain deeper understandings on the rationality of the design of the proposed graph test time training framework (GT3).

Xihong Yang, Yiqi Wang, Jin Chen et al.

Deep learning has been widely applied in recommender systems, which has achieved revolutionary progress recently. However, most existing learning-based methods assume that the user and item distributions remain unchanged between the training phase and the test phase. However, the distribution of user and item features can naturally shift in real-world scenarios, potentially resulting in a substantial decrease in recommendation performance. This phenomenon can be formulated as an Out-Of-Distribution (OOD) recommendation problem. To address this challenge, we propose a novel Dual Test-Time-Training framework for OOD Recommendation, termed DT3OR. In DT3OR, we incorporate a model adaptation mechanism during the test-time phase to carefully update the recommendation model, allowing the model to specially adapt to the shifting user and item features. To be specific, we propose a self-distillation task and a contrastive task to assist the model learning both the user's invariant interest preferences and the variant user/item characteristics during the test-time phase, thus facilitating a smooth adaptation to the shifting features. Furthermore, we provide theoretical analysis to support the rationale behind our dual test-time training framework. To the best of our knowledge, this paper is the first work to address OOD recommendation via a test-time-training strategy. We conduct experiments on three datasets with various backbones. Comprehensive experimental results have demonstrated the effectiveness of DT3OR compared to other state-of-the-art baselines.

Wenqi Fan, Xiangyu Zhao, Xiao Chen et al.

As one of the most successful AI-powered applications, recommender systems aim to help people make appropriate decisions in an effective and efficient way, by providing personalized suggestions in many aspects of our lives, especially for various human-oriented online services such as e-commerce platforms and social media sites. In the past few decades, the rapid developments of recommender systems have significantly benefited human by creating economic value, saving time and effort, and promoting social good. However, recent studies have found that data-driven recommender systems can pose serious threats to users and society, such as spreading fake news to manipulate public opinion in social media sites, amplifying unfairness toward under-represented groups or individuals in job matching services, or inferring privacy information from recommendation results. Therefore, systems' trustworthiness has been attracting increasing attention from various aspects for mitigating negative impacts caused by recommender systems, so as to enhance the public's trust towards recommender systems techniques. In this survey, we provide a comprehensive overview of Trustworthy Recommender systems (TRec) with a specific focus on six of the most important aspects; namely, Safety & Robustness, Nondiscrimination & Fairness, Explainability, Privacy, Environmental Well-being, and Accountability & Auditability. For each aspect, we summarize the recent related technologies and discuss potential research directions to help achieve trustworthy recommender systems in the future.

Qian Ma, Zijian Zhang, Xiangyu Zhao et al.

With the acceleration of urbanization, traffic forecasting has become an essential role in smart city construction. In the context of spatio-temporal prediction, the key lies in how to model the dependencies of sensors. However, existing works basically only consider the micro relationships between sensors, where the sensors are treated equally, and their macroscopic dependencies are neglected. In this paper, we argue to rethink the sensor's dependency modeling from two hierarchies: regional and global perspectives. Particularly, we merge original sensors with high intra-region correlation as a region node to preserve the inter-region dependency. Then, we generate representative and common spatio-temporal patterns as global nodes to reflect a global dependency between sensors and provide auxiliary information for spatio-temporal dependency learning. In pursuit of the generality and reality of node representations, we incorporate a Meta GCN to calibrate the regional and global nodes in the physical data space. Furthermore, we devise the cross-hierarchy graph convolution to propagate information from different hierarchies. In a nutshell, we propose a Hierarchical Information Enhanced Spatio-Temporal prediction method, HIEST, to create and utilize the regional dependency and common spatio-temporal patterns. Extensive experiments have verified the leading performance of our HIEST against state-of-the-art baselines. We publicize the code to ease reproducibility.

Xiaotian Han, Quanzeng You, Yongfei Liu et al.

Multi-modal Large Language Models (MLLMs) are increasingly prominent in the field of artificial intelligence. These models not only excel in traditional vision-language tasks but also demonstrate impressive performance in contemporary multi-modal benchmarks. Although many of these benchmarks attempt to holistically evaluate MLLMs, they typically concentrate on basic reasoning tasks, often yielding only simple yes/no or multi-choice responses. These methods naturally lead to confusion and difficulties in conclusively determining the reasoning capabilities of MLLMs. To mitigate this issue, we manually curate a benchmark dataset specifically designed for MLLMs, with a focus on complex reasoning tasks. Our benchmark comprises three key reasoning categories: deductive, abductive, and analogical reasoning. The queries in our dataset are intentionally constructed to engage the reasoning capabilities of MLLMs in the process of generating answers. For a fair comparison across various MLLMs, we incorporate intermediate reasoning steps into our evaluation criteria. In instances where an MLLM is unable to produce a definitive answer, its reasoning ability is evaluated by requesting intermediate reasoning steps. If these steps align with our manual annotations, appropriate scores are assigned. This evaluation scheme resembles methods commonly used in human assessments, such as exams or assignments, and represents what we consider a more effective assessment technique compared with existing benchmarks. We evaluate a selection of representative MLLMs using this rigorously developed open-ended multi-step elaborate reasoning benchmark, designed to challenge and accurately measure their reasoning capabilities. The code and data will be released at https://infimm.github.io/InfiMM-Eval/

Jiaxin Zhang, Yiqi Wang, Siwei Wang et al.

Graph Neural Networks frequently exhibit significant performance degradation in the out-of-distribution test scenario. While test-time training (TTT) offers a promising solution, existing Parameter Finetuning (PaFT) paradigm suffer from catastrophic forgetting, hindering their real-world applicability. We propose TTReFT, a novel Test-Time Representation FineTuning framework that transitions the adaptation target from model parameters to latent representations. Specifically, TTReFT achieves this through three key innovations: (1) uncertainty-guided node selection for specific interventions, (2) low-rank representation interventions that preserve pre-trained knowledge, and (3) an intervention-aware masked autoencoder that dynamically adjust masking strategy to accommodate the node selection scheme. Theoretically, we establish guarantees for TTReFT in OOD settings. Empirically, extensive experiments across five benchmark datasets demonstrate that TTReFT achieves consistent and superior performance. Our work establishes representation finetuning as a new paradigm for graph TTT, offering both theoretical grounding and immediate practical utility for real-world deployment.

Maolin Wang, Bowen Yu, Sheng Zhang et al.

Tensor network structure search (TN-SS) aims to automatically discover optimal network topologies and rank configurations for efficient tensor decomposition in high-dimensional data representation. Despite recent advances, existing TN-SS methods face significant limitations in computational tractability, structure adaptivity, and optimization robustness across diverse tensor characteristics. They struggle with three key challenges: single-scale optimization missing multi-scale structures, discrete search spaces hindering smooth structure evolution, and separated structure-parameter optimization causing computational inefficiency. We propose RGTN (Renormalization Group guided Tensor Network search), a physics-inspired framework transforming TN-SS via multi-scale renormalization group flows. Unlike fixed-scale discrete search methods, RGTN uses dynamic scale-transformation for continuous structure evolution across resolutions. Its core innovation includes learnable edge gates for optimization-stage topology modification and intelligent proposals based on physical quantities like node tension measuring local stress and edge information flow quantifying connectivity importance. Starting from low-complexity coarse scales and refining to finer ones, RGTN finds compact structures while escaping local minima via scale-induced perturbations. Extensive experiments on light field data, high-order synthetic tensors, and video completion tasks show RGTN achieves state-of-the-art compression ratios and runs 4-600$\times$ faster than existing methods, validating the effectiveness of our physics-inspired approach.

Yiming Lei, Yiqi Wang, Yujia Zhang et al.

Workbook-scale spreadsheet understanding is increasingly important for language-model-based data analysis agents, but remains challenging because relevant information is often distributed across multiple sheets with heterogeneous schemas, layouts, and implicit relationships. Existing retrieval-augmented approaches typically decompose spreadsheets into rows, columns, or blocks to improve scalability; however, such chunk-centric representations can fragment worksheets into isolated text spans and weaken global sheet-level semantics. We propose Sheet as Token, a graph-enhanced framework that treats each worksheet as a unified semantic unit for multi-sheet spreadsheet retrieval. Our method extracts schema-aware records from sheet names, column headers, representative values, and layout features, and encodes each worksheet into a compact dense token. Given a natural-language query, a Graph Retriever constructs a query-specific candidate graph over sheet tokens using semantic, query-conditioned, schema-consistency, and shape-compatibility relations, and composes these channels through a multi-stage graph transformer to retrieve supporting sheet sets. Experiments on a constructed multi-sheet spreadsheet corpus show that sheet-level tokenization learns stable representations, and that graph-enhanced cross-sheet reasoning improves listwise retrieval over a shallow graph baseline with limited additional graph-side computation. These results suggest that sheet-level tokenization is a promising abstraction for scalable multi-sheet spreadsheet understanding.

Haogeng Liu, Quanzeng You, Xiaotian Han et al.

Multimodal Large Language Models (MLLMs) have experienced significant advancements recently. Nevertheless, challenges persist in the accurate recognition and comprehension of intricate details within high-resolution images. Despite being indispensable for the development of robust MLLMs, this area remains underinvestigated. To tackle this challenge, our work introduces InfiMM-HD, a novel architecture specifically designed for processing images of different resolutions with low computational overhead. This innovation facilitates the enlargement of MLLMs to higher-resolution capabilities. InfiMM-HD incorporates a cross-attention module and visual windows to reduce computation costs. By integrating this architectural design with a four-stage training pipeline, our model attains improved visual perception efficiently and cost-effectively. Empirical study underscores the robustness and effectiveness of InfiMM-HD, opening new avenues for exploration in related areas. Codes and models can be found at https://huggingface.co/Infi-MM/infimm-hd

Yuqing Fu, Yimin Deng, Wanyu Wang et al.

Multi-hop Question Answering (MHQA) aims to answer questions that require multi-step reasoning. It presents two key challenges: generating correct reasoning paths in response to the complex user queries, and accurately retrieving essential knowledge in the face of potential limitations in large language models (LLMs). Existing approaches primarily rely on prompt-based methods to generate reasoning paths, which are further combined with traditional sparse or dense retrieval to produce the final answer. However, the generation of reasoning paths commonly lacks effective control over the generative process, thus leading the reasoning astray. Meanwhile, the retrieval methods over-rely on knowledge matching or similarity scores rather than evaluating the practical utility of the information, resulting in retrieving homogeneous or non-useful information. Therefore, we propose a Structured Entity-Aware Retrieval with Chain-of-Reasoning Navigator framework named SEARCH-R. Specifically, SEARCH-R trains an end-to-end reasoning path navigator, which is able to provide a powerful sub-question decomposer by fine-tuning the Llama3.1-8B model. Moreover, a novel dependency tree-based retrieval is designed to evaluate the informational contribution of the document quantitatively. Extensive experiments on three challenging multi-hop datasets validate the effectiveness of the proposed framework. The code and dataset are available at: https://github.com/Applied-Machine-Learning-Lab/ACL2026_SEARCH-R.

Yiqi Wang, Wentao Chen, Xiaotian Han et al.

Strong Artificial Intelligence (Strong AI) or Artificial General Intelligence (AGI) with abstract reasoning ability is the goal of next-generation AI. Recent advancements in Large Language Models (LLMs), along with the emerging field of Multimodal Large Language Models (MLLMs), have demonstrated impressive capabilities across a wide range of multimodal tasks and applications. Particularly, various MLLMs, each with distinct model architectures, training data, and training stages, have been evaluated across a broad range of MLLM benchmarks. These studies have, to varying degrees, revealed different aspects of the current capabilities of MLLMs. However, the reasoning abilities of MLLMs have not been systematically investigated. In this survey, we comprehensively review the existing evaluation protocols of multimodal reasoning, categorize and illustrate the frontiers of MLLMs, introduce recent trends in applications of MLLMs on reasoning-intensive tasks, and finally discuss current practices and future directions. We believe our survey establishes a solid base and sheds light on this important topic, multimodal reasoning.

Rui Li, Jianan Zhao, Chaozhuo Li et al.

The effectiveness of knowledge graph embedding (KGE) largely depends on the ability to model intrinsic relation patterns and mapping properties. However, existing approaches can only capture some of them with insufficient modeling capacity. In this work, we propose a more powerful KGE framework named HousE, which involves a novel parameterization based on two kinds of Householder transformations: (1) Householder rotations to achieve superior capacity of modeling relation patterns; (2) Householder projections to handle sophisticated relation mapping properties. Theoretically, HousE is capable of modeling crucial relation patterns and mapping properties simultaneously. Besides, HousE is a generalization of existing rotation-based models while extending the rotations to high-dimensional spaces. Empirically, HousE achieves new state-of-the-art performance on five benchmark datasets. Our code is available at https://github.com/anrep/HousE.

Xiaorui Liu, Wei Jin, Yao Ma et al.

While many existing graph neural networks (GNNs) have been proven to perform $\ell_2$-based graph smoothing that enforces smoothness globally, in this work we aim to further enhance the local smoothness adaptivity of GNNs via $\ell_1$-based graph smoothing. As a result, we introduce a family of GNNs (Elastic GNNs) based on $\ell_1$ and $\ell_2$-based graph smoothing. In particular, we propose a novel and general message passing scheme into GNNs. This message passing algorithm is not only friendly to back-propagation training but also achieves the desired smoothing properties with a theoretical convergence guarantee. Experiments on semi-supervised learning tasks demonstrate that the proposed Elastic GNNs obtain better adaptivity on benchmark datasets and are significantly robust to graph adversarial attacks. The implementation of Elastic GNNs is available at \url{https://github.com/lxiaorui/ElasticGNN}.

Wei Jin, Tyler Derr, Yiqi Wang et al.

Graph Neural Networks (GNNs) have achieved tremendous success in various real-world applications due to their strong ability in graph representation learning. GNNs explore the graph structure and node features by aggregating and transforming information within node neighborhoods. However, through theoretical and empirical analysis, we reveal that the aggregation process of GNNs tends to destroy node similarity in the original feature space. There are many scenarios where node similarity plays a crucial role. Thus, it has motivated the proposed framework SimP-GCN that can effectively and efficiently preserve node similarity while exploiting graph structure. Specifically, to balance information from graph structure and node features, we propose a feature similarity preserving aggregation which adaptively integrates graph structure and node features. Furthermore, we employ self-supervised learning to explicitly capture the complex feature similarity and dissimilarity relations between nodes. We validate the effectiveness of SimP-GCN on seven benchmark datasets including three assortative and four disassorative graphs. The results demonstrate that SimP-GCN outperforms representative baselines. Further probe shows various advantages of the proposed framework. The implementation of SimP-GCN is available at \url{https://github.com/ChandlerBang/SimP-GCN}.

Wei Jin, Tyler Derr, Haochen Liu et al.

The success of deep learning notoriously requires larger amounts of costly annotated data. This has led to the development of self-supervised learning (SSL) that aims to alleviate this limitation by creating domain specific pretext tasks on unlabeled data. Simultaneously, there are increasing interests in generalizing deep learning to the graph domain in the form of graph neural networks (GNNs). GNNs can naturally utilize unlabeled nodes through the simple neighborhood aggregation that is unable to thoroughly make use of unlabeled nodes. Thus, we seek to harness SSL for GNNs to fully exploit the unlabeled data. Different from data instances in the image and text domains, nodes in graphs present unique structure information and they are inherently linked indicating not independent and identically distributed (or i.i.d.). Such complexity is a double-edged sword for SSL on graphs. On the one hand, it determines that it is challenging to adopt solutions from the image and text domains to graphs and dedicated efforts are desired. On the other hand, it provides rich information that enables us to build SSL from a variety of perspectives. Thus, in this paper, we first deepen our understandings on when, why, and which strategies of SSL work with GNNs by empirically studying numerous basic SSL pretext tasks on graphs. Inspired by deep insights from the empirical studies, we propose a new direction SelfTask to build advanced pretext tasks that are able to achieve state-of-the-art performance on various real-world datasets. The specific experimental settings to reproduce our results can be found in \url{https://github.com/ChandlerBang/SelfTask-GNN}.

Wei Jin, Yaxin Li, Han Xu et al.

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 to graphs, Graph Neural Networks (GNNs) have been demonstrated to inherit this vulnerability. Adversary can mislead GNNs to give wrong predictions by modifying the graph structure such as manipulating a few edges. This vulnerability has arisen tremendous concerns for adapting GNNs in safety-critical applications and has attracted increasing research attention in recent years. Thus, it is necessary and timely to provide a comprehensive overview of existing graph adversarial attacks and the countermeasures. In this survey, we categorize existing attacks and defenses, and review the corresponding state-of-the-art methods. Furthermore, we have developed a repository with representative algorithms (https://github.com/DSE-MSU/DeepRobust/tree/master/deeprobust/graph). The repository enables us to conduct empirical studies to deepen our understandings on attacks and defenses on graphs.

Langming Liu, Wanyu Wang, Xiangyu Zhao et al.

Recommender systems play a pivotal role across practical scenarios, showcasing remarkable capabilities in user preference modeling. However, the centralized learning paradigm predominantly used raises serious privacy concerns. The federated recommender system (FedRS) addresses this by updating models on clients, while a central server orchestrates training without accessing private data. Existing FedRS approaches, however, face unresolved challenges, including non-convex optimization, vulnerability, potential privacy leakage risk, and communication inefficiency. This paper addresses these challenges by reformulating the federated recommendation problem as a convex optimization issue, ensuring convergence to the global optimum. Based on this, we devise a novel method, RFRec, to tackle this optimization problem efficiently. In addition, we propose RFRecF, a highly efficient version that incorporates non-uniform stochastic gradient descent to improve communication efficiency. In user preference modeling, both methods learn local and global models, collaboratively learning users' common and personalized interests under the federated learning setting. Moreover, both methods significantly enhance communication efficiency, robustness, and privacy protection, with theoretical support. Comprehensive evaluations on four benchmark datasets demonstrate RFRec and RFRecF's superior performance compared to diverse baselines.

Jiaxin Zhang, Yiqi Wang, Xihong Yang et al.

Graph Neural Networks have demonstrated great success in various fields of multimedia. However, the distribution shift between the training and test data challenges the effectiveness of GNNs. To mitigate this challenge, Test-Time Training (TTT) has been proposed as a promising approach. Traditional TTT methods require a demanding unsupervised training strategy to capture the information from test to benefit the main task. Inspired by the great annotation ability of Large Language Models (LLMs) on Text-Attributed Graphs (TAGs), we propose to enhance the test-time training on graphs with LLMs as annotators. In this paper, we design a novel Test-Time Training pipeline, LLMTTT, which conducts the test-time adaptation under the annotations by LLMs on a carefully-selected node set. Specifically, LLMTTT introduces a hybrid active node selection strategy that considers not only node diversity and representativeness, but also prediction signals from the pre-trained model. Given annotations from LLMs, a two-stage training strategy is designed to tailor the test-time model with the limited and noisy labels. A theoretical analysis ensures the validity of our method and extensive experiments demonstrate that the proposed LLMTTT can achieve a significant performance improvement compared to existing Out-of-Distribution (OOD) generalization methods.

Yiqi Wang, Mrinal Verghese, Jeff Schneider

Learning visuomotor policies via imitation has proven effective across a wide range of robotic domains. However, the performance of these policies is heavily dependent on the number of training demonstrations, which requires expensive data collection in the real world. In this work, we aim to reduce data collection efforts when learning visuomotor robot policies by leveraging existing or cost-effective data from a wide range of embodiments, such as public robot datasets and the datasets of humans playing with objects (human data from play). Our approach leverages two key insights. First, we use optic flow as an embodiment-agnostic action representation to train a World Model (WM) across multi-embodiment datasets, and finetune it on a small amount of robot data from the target embodiment. Second, we develop a method, Latent Policy Steering (LPS), to improve the output of a behavior-cloned policy by searching in the latent space of the WM for better action sequences. In real world experiments, we observe significant improvements in the performance of policies trained with a small amount of data (over 50% relative improvement with 30 demonstrations and over 20% relative improvement with 50 demonstrations) by combining the policy with a WM pretrained on two thousand episodes sampled from the existing Open X-embodiment dataset across different robots or a cost-effective human dataset from play.

Haohao Qu, Shanru Lin, Yujuan Ding et al.

Recent advances in generative artificial intelligence, particularly large language models (LLMs), have opened new opportunities for enhancing recommender systems (RecSys). Most existing LLM-based RecSys approaches operate in a discrete space, using vector-quantized tokenizers to align with the inherent discrete nature of language models. However, these quantization methods often result in lossy tokenization and suboptimal learning, primarily due to inaccurate gradient propagation caused by the non-differentiable argmin operation in standard vector quantization. Inspired by the emerging trend of embracing continuous tokens in language models, we propose ContRec, a novel framework that seamlessly integrates continuous tokens into LLM-based RecSys. Specifically, ContRec consists of two key modules: a sigma-VAE Tokenizer, which encodes users/items with continuous tokens; and a Dispersive Diffusion module, which captures implicit user preference. The tokenizer is trained with a continuous Variational Auto-Encoder (VAE) objective, where three effective techniques are adopted to avoid representation collapse. By conditioning on the previously generated tokens of the LLM backbone during user modeling, the Dispersive Diffusion module performs a conditional diffusion process with a novel Dispersive Loss, enabling high-quality user preference generation through next-token diffusion. Finally, ContRec leverages both the textual reasoning output from the LLM and the latent representations produced by the diffusion model for Top-K item retrieval, thereby delivering comprehensive recommendation results. Extensive experiments on four datasets demonstrate that ContRec consistently outperforms both traditional and SOTA LLM-based recommender systems. Our results highlight the potential of continuous tokenization and generative modeling for advancing the next generation of recommender systems.

Yu Shi, Yiqi Wang, WeiXuan Lang et al.

Nodes in the real-world graphs exhibit diverse patterns in numerous aspects, such as degree and homophily. However, most existent node predictors fail to capture a wide range of node patterns or to make predictions based on distinct node patterns, resulting in unsatisfactory classification performance. In this paper, we reveal that different node predictors are good at handling nodes with specific patterns and only apply one node predictor uniformly could lead to suboptimal result. To mitigate this gap, we propose a mixture of experts framework, MoE-NP, for node classification. Specifically, MoE-NP combines a mixture of node predictors and strategically selects models based on node patterns. Experimental results from a range of real-world datasets demonstrate significant performance improvements from MoE-NP.

Xiaotian Han, Yiqi Wang, Bohan Zhai et al.

Multi-modal Large Language Models (MLLMs) are increasingly prominent in the field of artificial intelligence. Visual instruction fine-tuning (IFT) is a vital process for aligning MLLMs' output with user's intentions. High-quality and diversified instruction following data is the key to this fine-tuning process. Recent studies propose to construct visual IFT datasets through a multifaceted approach: transforming existing datasets with rule-based templates, employing GPT-4 for rewriting annotations, and utilizing GPT-4V for visual dataset pseudo-labeling. LLaVA-1.5 adopted similar approach and construct LLaVA-mix-665k, which is one of the simplest, most widely used, yet most effective IFT datasets today. Notably, when properly fine-tuned with this dataset, MLLMs can achieve state-of-the-art performance on several benchmarks. However, we noticed that models trained with this dataset often struggle to follow user instructions properly in multi-round dialog. In addition, tradition caption and VQA evaluation benchmarks, with their closed-form evaluation structure, are not fully equipped to assess the capabilities of modern open-ended generative MLLMs. This problem is not unique to the LLaVA-mix-665k dataset, but may be a potential issue in all IFT datasets constructed from image captioning or VQA sources, though the extent of this issue may vary. We argue that datasets with diverse and high-quality detailed instruction following annotations are essential and adequate for MLLMs IFT. In this work, we establish a new IFT dataset, with images sourced from the COCO dataset along with more diverse instructions. Our experiments show that when fine-tuned with out proposed dataset, MLLMs achieve better performance on open-ended evaluation benchmarks in both single-round and multi-round dialog setting.

Jiaxi Hu, Jingtong Gao, Xiangyu Zhao et al.

The integration of multimodal information into sequential recommender systems has attracted significant attention in recent research. In the initial stages of multimodal sequential recommendation models, the mainstream paradigm was ID-dominant recommendations, wherein multimodal information was fused as side information. However, due to their limitations in terms of transferability and information intrusion, another paradigm emerged, wherein multimodal features were employed directly for recommendation, enabling recommendation across datasets. Nonetheless, it overlooked user ID information, resulting in low information utilization and high training costs. To this end, we propose an innovative framework, BivRec, that jointly trains the recommendation tasks in both ID and multimodal views, leveraging their synergistic relationship to enhance recommendation performance bidirectionally. To tackle the information heterogeneity issue, we first construct structured user interest representations and then learn the synergistic relationship between them. Specifically, BivRec comprises three modules: Multi-scale Interest Embedding, comprehensively modeling user interests by expanding user interaction sequences with multi-scale patching; Intra-View Interest Decomposition, constructing highly structured interest representations using carefully designed Gaussian attention and Cluster attention; and Cross-View Interest Learning, learning the synergistic relationship between the two recommendation views through coarse-grained overall semantic similarity and fine-grained interest allocation similarity BiVRec achieves state-of-the-art performance on five datasets and showcases various practical advantages.

Yifan Wu, Jiyue Jiang, Xichen Ye et al.

Biological foundation models (BioFMs), pretrained on large-scale biological sequences, have recently shown strong potential in providing meaningful representations for diverse downstream bioinformatics tasks. However, such models often rely on millions to billions of training sequences and billions of parameters, resulting in prohibitive computational costs and significant barriers to reproducibility and accessibility, particularly for academic labs. To address these challenges, we investigate the feasibility of data pruning for BioFM pretraining and propose a post-hoc influence-guided data pruning framework tailored to biological domains. Our approach introduces a subset-based self-influence formulation that enables efficient estimation of sample importance at low computational cost, and builds upon it two simple yet effective selection strategies, namely Top-k Influence (Top I) and Coverage-Centric Influence (CCI). We empirically validate our method on two representative BioFMs, RNA-FM and ESM-C. For RNA, our framework consistently outperforms random selection baselines under an extreme pruning rate of over 99 percent, demonstrating its effectiveness. Furthermore, we show the generalizability of our framework on protein-related tasks using ESM-C. In particular, our coreset even outperforms random subsets that are ten times larger in both RNA and protein settings, revealing substantial redundancy in biological sequence datasets. These findings underscore the potential of influence-guided data pruning to substantially reduce the computational cost of BioFM pretraining, paving the way for more efficient, accessible, and sustainable biological AI research.

Guojie Liu, Yiqi Wang, Yanfeng Yang et al.

Providing extensive context via prompting is vital for leveraging the capabilities of Large Language Models (LLMs). However, lengthy contexts significantly increase inference latency, as the computational cost of self-attention grows quadratically with sequence length. To mitigate this issue, context compression-particularly soft prompt compressio-has emerged as a widely studied solution, which converts long contexts into shorter memory embeddings via a trained compressor. Existing methods typically compress the entire context indiscriminately into a set of memory tokens, requiring the compressor to capture global dependencies and necessitating extensive pre-training data to learn effective patterns. Inspired by the chunking mechanism in human working memory and empirical observations of the spatial specialization of memory embeddings relative to original tokens, we propose Parallelized Iterative Compression (PIC). By simply modifying the Transformer's attention mask, PIC explicitly restricts the receptive field of memory tokens to sequential local chunks, thereby lowering the difficulty of compressor training. Experiments across multiple downstream tasks demonstrate that PIC consistently outperforms competitive baselines, with superiority being particularly pronounced in high compression scenarios (e.g., achieving relative improvements of 29.8\% in F1 score and 40.7\% in EM score on QA tasks at the $64\times$ compression ratio). Furthermore, PIC significantly expedites the training process. Specifically, when training the 16$\times$ compressor, it surpasses the peak performance of the competitive baseline while effectively reducing the training time by approximately 40\%.

Xiaopeng Li, Yuanjin Zheng, Wanyu Wang et al.

Personalized Large Language Models (PLLMs) aim to align model outputs with individual user preferences, a crucial capability for user-centric applications. However, the prevalent approach of fine-tuning a separate module for each user faces two major limitations: (1) storage costs scale linearly with the number of users, rendering the method unscalable; and (2) fine-tuning a static model from scratch often yields suboptimal performance for users with sparse data. To address these challenges, we propose MTA, a Merge-then-Adapt framework for PLLMs. MTA comprises three key stages. First, we construct a shared Meta-LoRA Bank by selecting anchor users and pre-training meta-personalization traits within meta-LoRA modules. Second, to ensure scalability and enable dynamic personalization combination beyond static models, we introduce an Adaptive LoRA Fusion stage. This stage retrieves and dynamically merges the most relevant anchor meta-LoRAs to synthesize a user-specific one, thereby eliminating the need for user-specific storage and supporting more flexible personalization. Third, we propose a LoRA Stacking for Few-Shot Personalization stage, which applies an additional ultra-low-rank, lightweight LoRA module on top of the merged LoRA. Fine-tuning this module enables effective personalization under few-shot settings. Extensive experiments on the LaMP benchmark demonstrate that our approach outperforms existing SOTA methods across multiple tasks.

Maolin Wang, Yu Pan, Zenglin Xu et al.

Temporal Point Processes (TPPs) hold a pivotal role in modeling event sequences across diverse domains, including social networking and e-commerce, and have significantly contributed to the advancement of recommendation systems and information retrieval strategies. Through the analysis of events such as user interactions and transactions, TPPs offer valuable insights into behavioral patterns, facilitating the prediction of future trends. However, accurately forecasting future events remains a formidable challenge due to the intricate nature of these patterns. The integration of Neural Networks with TPPs has ushered in the development of advanced deep TPP models. While these models excel at processing complex and nonlinear temporal data, they encounter limitations in modeling intensity functions, grapple with computational complexities in integral computations, and struggle to capture long-range temporal dependencies effectively. In this study, we introduce the CuFun model, representing a novel approach to TPPs that revolves around the Cumulative Distribution Function (CDF). CuFun stands out by uniquely employing a monotonic neural network for CDF representation, utilizing past events as a scaling factor. This innovation significantly bolsters the model's adaptability and precision across a wide range of data scenarios. Our approach addresses several critical issues inherent in traditional TPP modeling: it simplifies log-likelihood calculations, extends applicability beyond predefined density function forms, and adeptly captures long-range temporal patterns. Our contributions encompass the introduction of a pioneering CDF-based TPP model, the development of a methodology for incorporating past event information into future event prediction, and empirical validation of CuFun's effectiveness through extensive experimentation on synthetic and real-world datasets.

Yingjie Tian, Yiqi Wang, Xianda Guo et al.

In recent years, soft prompt learning methods have been proposed to fine-tune large-scale vision-language pre-trained models for various downstream tasks. These methods typically combine learnable textual tokens with class tokens as input for models with frozen parameters. However, they often employ a single prompt to describe class contexts, failing to capture categories' diverse attributes adequately. This study introduces the Partitioned Multi-modal Prompt (PMPO), a multi-modal prompting technique that extends the soft prompt from a single learnable prompt to multiple prompts. Our method divides the visual encoder depths and connects learnable prompts to the separated visual depths, enabling different prompts to capture the hierarchical contextual depths of visual representations. Furthermore, to maximize the advantages of multi-prompt learning, we incorporate prior information from manually designed templates and learnable multi-prompts, thus improving the generalization capabilities of our approach. We evaluate the effectiveness of our approach on three challenging tasks: new class generalization, cross-dataset evaluation, and domain generalization. For instance, our method achieves a $79.28$ harmonic mean, averaged over 11 diverse image recognition datasets ($+7.62$ compared to CoOp), demonstrating significant competitiveness compared to state-of-the-art prompting methods.

Yiqi Wang, Chaozhuo Li, Zheng Liu et al.

Graph neural networks (GNNs) have been widely applied in the recommendation tasks and have obtained very appealing performance. However, most GNN-based recommendation methods suffer from the problem of data sparsity in practice. Meanwhile, pre-training techniques have achieved great success in mitigating data sparsity in various domains such as natural language processing (NLP) and computer vision (CV). Thus, graph pre-training has the great potential to alleviate data sparsity in GNN-based recommendations. However, pre-training GNNs for recommendations face unique challenges. For example, user-item interaction graphs in different recommendation tasks have distinct sets of users and items, and they often present different properties. Therefore, the successful mechanisms commonly used in NLP and CV to transfer knowledge from pre-training tasks to downstream tasks such as sharing learned embeddings or feature extractors are not directly applicable to existing GNN-based recommendations models. To tackle these challenges, we delicately design an adaptive graph pre-training framework for localized collaborative filtering (ADAPT). It does not require transferring user/item embeddings, and is able to capture both the common knowledge across different graphs and the uniqueness for each graph. Extensive experimental results have demonstrated the effectiveness and superiority of ADAPT.

Jianan Zhao, Chaozhuo Li, Qianlong Wen et al.

Transformers have achieved remarkable performance in a myriad of fields including natural language processing and computer vision. However, when it comes to the graph mining area, where graph neural network (GNN) has been the dominant paradigm, transformers haven't achieved competitive performance, especially on the node classification task. Existing graph transformer models typically adopt fully-connected attention mechanism on the whole input graph and thus suffer from severe scalability issues and are intractable to train in data insufficient cases. To alleviate these issues, we propose a novel Gophormer model which applies transformers on ego-graphs instead of full-graphs. Specifically, Node2Seq module is proposed to sample ego-graphs as the input of transformers, which alleviates the challenge of scalability and serves as an effective data augmentation technique to boost model performance. Moreover, different from the feature-based attention strategy in vanilla transformers, we propose a proximity-enhanced attention mechanism to capture the fine-grained structural bias. In order to handle the uncertainty introduced by the ego-graph sampling, we further propose a consistency regularization and a multi-sample inference strategy for stabilized training and testing, respectively. Extensive experiments on six benchmark datasets are conducted to demonstrate the superiority of Gophormer over existing graph transformers and popular GNNs, revealing the promising future of graph transformers.

Yiqi Wang, Chaozhuo Li, Mingzheng Li et al.

User-item interactions in recommendations can be naturally de-noted as a user-item bipartite graph. Given the success of graph neural networks (GNNs) in graph representation learning, GNN-based C methods have been proposed to advance recommender systems. These methods often make recommendations based on the learned user and item embeddings. However, we found that they do not perform well wit sparse user-item graphs which are quite common in real-world recommendations. Therefore, in this work, we introduce a novel perspective to build GNN-based CF methods for recommendations which leads to the proposed framework Localized Graph Collaborative Filtering (LGCF). One key advantage of LGCF is that it does not need to learn embeddings for each user and item, which is challenging in sparse scenarios. Alternatively, LGCF aims at encoding useful CF information into a localized graph and making recommendations based on such graph. Extensive experiments on various datasets validate the effectiveness of LGCF especially in sparse scenarios. Furthermore, empirical results demonstrate that LGCF provides complementary information to the embedding-based CF model which can be utilized to boost recommendation performance.

Haochen Liu, Yiqi Wang, Wenqi Fan et al.

In the past few decades, artificial intelligence (AI) technology has experienced swift developments, changing everyone's daily life and profoundly altering the course of human society. The intention of developing AI is to benefit humans, by reducing human labor, bringing everyday convenience to human lives, and promoting social good. However, recent research and AI applications show that AI can cause unintentional harm to humans, such as making unreliable decisions in safety-critical scenarios or undermining fairness by inadvertently discriminating against one group. Thus, trustworthy AI has attracted immense attention recently, which requires careful consideration to avoid the adverse effects that AI may bring to humans, so that humans can fully trust and live in harmony with AI technologies. Recent years have witnessed a tremendous amount of research on trustworthy AI. In this survey, we present a comprehensive survey of trustworthy AI from a computational perspective, to help readers understand the latest technologies for achieving trustworthy AI. Trustworthy AI is a large and complex area, involving various dimensions. In this work, we focus on six of the most crucial dimensions in achieving trustworthy AI: (i) Safety & Robustness, (ii) Non-discrimination & Fairness, (iii) Explainability, (iv) Privacy, (v) Accountability & Auditability, and (vi) Environmental Well-Being. For each dimension, we review the recent related technologies according to a taxonomy and summarize their applications in real-world systems. We also discuss the accordant and conflicting interactions among different dimensions and discuss potential aspects for trustworthy AI to investigate in the future.

Haochen Liu, Wentao Wang, Yiqi Wang et al.

Dialogue systems play an increasingly important role in various aspects of our daily life. It is evident from recent research that dialogue systems trained on human conversation data are biased. In particular, they can produce responses that reflect people's gender prejudice. Many debiasing methods have been developed for various NLP tasks, such as word embedding. However, they are not directly applicable to dialogue systems because they are likely to force dialogue models to generate similar responses for different genders. This greatly degrades the diversity of the generated responses and immensely hurts the performance of the dialogue models. In this paper, we propose a novel adversarial learning framework Debiased-Chat to train dialogue models free from gender bias while keeping their performance. Extensive experiments on two real-world conversation datasets show that our framework significantly reduces gender bias in dialogue models while maintaining the response quality. The implementation of the proposed framework is released.

Xianfeng Tang, Huaxiu Yao, Yiwei Sun et al.

Graph Convolutional Networks (GCNs) show promising results for semi-supervised learning tasks on graphs, thus become favorable comparing with other approaches. Despite the remarkable success of GCNs, it is difficult to train GCNs with insufficient supervision. When labeled data are limited, the performance of GCNs becomes unsatisfying for low-degree nodes. While some prior work analyze successes and failures of GCNs on the entire model level, profiling GCNs on individual node level is still underexplored. In this paper, we analyze GCNs in regard to the node degree distribution. From empirical observation to theoretical proof, we confirm that GCNs are biased towards nodes with larger degrees with higher accuracy on them, even if high-degree nodes are underrepresented in most graphs. We further develop a novel Self-Supervised-Learning Degree-Specific GCN (SL-DSGC) that mitigate the degree-related biases of GCNs from model and data aspects. Firstly, we propose a degree-specific GCN layer that captures both discrepancies and similarities of nodes with different degrees, which reduces the inner model-aspect biases of GCNs caused by sharing the same parameters with all nodes. Secondly, we design a self-supervised-learning algorithm that creates pseudo labels with uncertainty scores on unlabeled nodes with a Bayesian neural network. Pseudo labels increase the chance of connecting to labeled neighbors for low-degree nodes, thus reducing the biases of GCNs from the data perspective. Uncertainty scores are further exploited to weight pseudo labels dynamically in the stochastic gradient descent for SL-DSGC. Experiments on three benchmark datasets show SL-DSGC not only outperforms state-of-the-art self-training/self-supervised-learning GCN methods, but also improves GCN accuracy dramatically for low-degree nodes.

Yiqi Wang, Yao Ma, Wei Jin et al.

Recently, Graph Neural Networks (GNNs) have greatly advanced the task of graph classification. Typically, we first build a unified GNN model with graphs in a given training set and then use this unified model to predict labels of all the unseen graphs in the test set. However, graphs in the same dataset often have dramatically distinct structures, which indicates that a unified model may be sub-optimal given an individual graph. Therefore, in this paper, we aim to develop customized graph neural networks for graph classification. Specifically, we propose a novel customized graph neural network framework, i.e., Customized-GNN. Given a graph sample, Customized-GNN can generate a sample-specific model for this graph based on its structure. Meanwhile, the proposed framework is very general that can be applied to numerous existing graph neural network models. Comprehensive experiments on various graph classification benchmarks demonstrate the effectiveness of the proposed framework.