Yada Zhu

Zhining Liu, Ruizhong Qiu, Zhichen Zeng et al.

Class imbalance is prevalent in real-world node classification tasks and poses great challenges for graph learning models. Most existing studies are rooted in a class-rebalancing (CR) perspective and address class imbalance with class-wise reweighting or resampling. In this work, we approach the root cause of class-imbalance bias from an topological paradigm. Specifically, we theoretically reveal two fundamental phenomena in the graph topology that greatly exacerbate the predictive bias stemming from class imbalance. On this basis, we devise a lightweight topological augmentation framework BAT to mitigate the class-imbalance bias without class rebalancing. Being orthogonal to CR, BAT can function as an efficient plug-and-play module that can be seamlessly combined with and significantly boost existing CR techniques. Systematic experiments on real-world imbalanced graph learning tasks show that BAT can deliver up to 46.27% performance gain and up to 72.74% bias reduction over existing techniques. Code, examples, and documentations are available at https://github.com/ZhiningLiu1998/BAT.

Baoyu Jing, Yuchen Yan, Yada Zhu et al.

Bipartite graphs are powerful data structures to model interactions between two types of nodes, which have been used in a variety of applications, such as recommender systems, information retrieval, and drug discovery. A fundamental challenge for bipartite graphs is how to learn informative node embeddings. Despite the success of recent self-supervised learning methods on bipartite graphs, their objectives are discriminating instance-wise positive and negative node pairs, which could contain cluster-level errors. In this paper, we introduce a novel co-cluster infomax (COIN) framework, which captures the cluster-level information by maximizing the mutual information of co-clusters. Different from previous infomax methods which estimate mutual information by neural networks, COIN could easily calculate mutual information. Besides, COIN is an end-to-end coclustering method which can be trained jointly with other objective functions and optimized via back-propagation. Furthermore, we also provide theoretical analysis for COIN. We theoretically prove that COIN is able to effectively increase the mutual information of node embeddings and COIN is upper-bounded by the prior distributions of nodes. We extensively evaluate the proposed COIN framework on various benchmark datasets and tasks to demonstrate the effectiveness of COIN.

Baoyu Jing, Si Zhang, Yada Zhu et al.

Time series data appears in a variety of applications such as smart transportation and environmental monitoring. One of the fundamental problems for time series analysis is time series forecasting. Despite the success of recent deep time series forecasting methods, they require sufficient observation of historical values to make accurate forecasting. In other words, the ratio of the output length (or forecasting horizon) to the sum of the input and output lengths should be low enough (e.g., 0.3). As the ratio increases (e.g., to 0.8), the uncertainty for the forecasting accuracy increases significantly. In this paper, we show both theoretically and empirically that the uncertainty could be effectively reduced by retrieving relevant time series as references. In the theoretical analysis, we first quantify the uncertainty and show its connections to the Mean Squared Error (MSE). Then we prove that models with references are easier to learn than models without references since the retrieved references could reduce the uncertainty. To empirically demonstrate the effectiveness of the retrieval based time series forecasting models, we introduce a simple yet effective two-stage method, called ReTime consisting of a relational retrieval and a content synthesis. We also show that ReTime can be easily adapted to the spatial-temporal time series and time series imputation settings. Finally, we evaluate ReTime on real-world datasets to demonstrate its effectiveness.

Xuying Ning, Dongqi Fu, Tianxin Wei et al.

With the increasing demand for step-wise, cross-modal, and knowledge-grounded reasoning, multimodal large language models (MLLMs) are evolving beyond the traditional fixed retrieve-then-generate paradigm toward more sophisticated agentic multimodal retrieval-augmented generation (MM-RAG). Existing benchmarks, however, mainly focus on simplified QA with short retrieval chains, leaving adaptive planning and multimodal reasoning underexplored. We present MC-Search, the first benchmark for agentic MM-RAG with long, step-wise annotated reasoning chains spanning five representative reasoning structures. Each example specifies sub-questions, retrieval modalities, supporting facts, and intermediate answers, with fidelity ensured by HAVE (Hop-wise Attribution and Verification of Evidence), resulting in 3,333 high-quality examples averaging 3.7 hops. Beyond answer accuracy, MC-Search introduces new process-level metrics for reasoning quality, stepwise retrieval and planning accuracy. By developing a unified agentic MM-RAG pipeline, we benchmark six leading MLLMs and reveal systematic issues such as over- and under-retrieval and modality-misaligned planning. Finally, we introduce Search-Align, a process-supervised fine-tuning framework leveraging verified reasoning chains, showing that our data not only enables faithful evaluation but also improves planning and retrieval fidelity in open-source MLLMs.

Shengyu Feng, Baoyu Jing, Yada Zhu et al.

Contrastive learning is an effective unsupervised method in graph representation learning, and the key component of contrastive learning lies in the construction of positive and negative samples. Previous methods usually utilize the proximity of nodes in the graph as the principle. Recently, the data-augmentation-based contrastive learning method has advanced to show great power in the visual domain, and some works extended this method from images to graphs. However, unlike the data augmentation on images, the data augmentation on graphs is far less intuitive and much harder to provide high-quality contrastive samples, which leaves much space for improvement. In this work, by introducing an adversarial graph view for data augmentation, we propose a simple but effective method, Adversarial Graph Contrastive Learning (ARIEL), to extract informative contrastive samples within reasonable constraints. We develop a new technique called information regularization for stable training and use subgraph sampling for scalability. We generalize our method from node-level contrastive learning to the graph level by treating each graph instance as a super-node. ARIEL consistently outperforms the current graph contrastive learning methods for both node-level and graph-level classification tasks on real-world datasets. We further demonstrate that ARIEL is more robust in the face of adversarial attacks.

Junmo Kang, Hongyin Luo, Yada Zhu et al. · gatech

Recent works have demonstrated the effectiveness of self-alignment in which a large language model is aligned to follow general instructions using instructional data generated from the model itself starting from a handful of human-written seeds. Instead of general alignment, in this work, we focus on self-alignment for expert domain specialization (e.g., biomedicine, finance). As a preliminary, we quantitively show the marginal effect that generic instruction-following training has on downstream expert domains' performance. To remedy this, we propose self-specialization - allowing for effective model specialization while achieving cross-task generalization by leveraging only a few labeled seeds. Self-specialization offers a data- and parameter-efficient way of "carving out" an expert model out of a generalist pre-trained LLM. Exploring a variety of popular open large models as a base for specialization, our experimental results in both biomedical and financial domains show that our self-specialized models outperform their base models by a large margin, and even larger models that are generally instruction-tuned or that have been adapted to the target domain by other means.

Baoyu Jing, Yuchen Yan, Kaize Ding et al.

A fundamental challenge of bipartite graph representation learning is how to extract informative node embeddings. Self-Supervised Learning (SSL) is a promising paradigm to address this challenge. Most recent bipartite graph SSL methods are based on contrastive learning which learns embeddings by discriminating positive and negative node pairs. Contrastive learning usually requires a large number of negative node pairs, which could lead to computational burden and semantic errors. In this paper, we introduce a novel synergistic representation learning model (STERLING) to learn node embeddings without negative node pairs. STERLING preserves the unique local and global synergies in bipartite graphs. The local synergies are captured by maximizing the similarity of the inter-type and intra-type positive node pairs, and the global synergies are captured by maximizing the mutual information of co-clusters. Theoretical analysis demonstrates that STERLING could improve the connectivity between different node types in the embedding space. Extensive empirical evaluation on various benchmark datasets and tasks demonstrates the effectiveness of STERLING for extracting node embeddings.

Lecheng Zheng, Dawei Zhou, Hanghang Tong et al.

There have been tremendous efforts over the past decades dedicated to the generation of realistic graphs in a variety of domains, ranging from social networks to computer networks, from gene regulatory networks to online transaction networks. Despite the remarkable success, the vast majority of these works are unsupervised in nature and are typically trained to minimize the expected graph reconstruction loss, which would result in the representation disparity issue in the generated graphs, i.e., the protected groups (often minorities) contribute less to the objective and thus suffer from systematically higher errors. In this paper, we aim to tailor graph generation to downstream mining tasks by leveraging label information and user-preferred parity constraints. In particular, we start from the investigation of representation disparity in the context of graph generative models. To mitigate the disparity, we propose a fairness-aware graph generative model named FairGen. Our model jointly trains a label-informed graph generation module and a fair representation learning module by progressively learning the behaviors of the protected and unprotected groups, from the `easy' concepts to the `hard' ones. In addition, we propose a generic context sampling strategy for graph generative models, which is proven to be capable of fairly capturing the contextual information of each group with a high probability. Experimental results on seven real-world data sets, including web-based graphs, demonstrate that FairGen (1) obtains performance on par with state-of-the-art graph generative models across nine network properties, (2) mitigates the representation disparity issues in the generated graphs, and (3) substantially boosts the model performance by up to 17% in downstream tasks via data augmentation.

Binchi Zhang, Yushun Dong, Chen Chen et al.

Fairness-aware graph neural networks (GNNs) have gained a surge of attention as they can reduce the bias of predictions on any demographic group (e.g., female) in graph-based applications. Although these methods greatly improve the algorithmic fairness of GNNs, the fairness can be easily corrupted by carefully designed adversarial attacks. In this paper, we investigate the problem of adversarial attacks on fairness of GNNs and propose G-FairAttack, a general framework for attacking various types of fairness-aware GNNs in terms of fairness with an unnoticeable effect on prediction utility. In addition, we propose a fast computation technique to reduce the time complexity of G-FairAttack. The experimental study demonstrates that G-FairAttack successfully corrupts the fairness of different types of GNNs while keeping the attack unnoticeable. Our study on fairness attacks sheds light on potential vulnerabilities in fairness-aware GNNs and guides further research on the robustness of GNNs in terms of fairness.

Lecheng Zheng, Yada Zhu, Jingrui He

In the era of big data, we are often facing the challenge of data heterogeneity and the lack of label information simultaneously. In the financial domain (e.g., fraud detection), the heterogeneous data may include not only numerical data (e.g., total debt and yearly income), but also text and images (e.g., financial statement and invoice images). At the same time, the label information (e.g., fraud transactions) may be missing for building predictive models. To address these challenges, many state-of-the-art multi-view clustering methods have been proposed and achieved outstanding performance. However, these methods typically do not take into consideration the fairness aspect and are likely to generate biased results using sensitive information such as race and gender. Therefore, in this paper, we propose a fairness-aware multi-view clustering method named FairMVC. It incorporates the group fairness constraint into the soft membership assignment for each cluster to ensure that the fraction of different groups in each cluster is approximately identical to the entire data set. Meanwhile, we adopt the idea of both contrastive learning and non-contrastive learning and propose novel regularizers to handle heterogeneous data in complex scenarios with missing data or noisy features. Experimental results on real-world data sets demonstrate the effectiveness and efficiency of the proposed framework. We also derive insights regarding the relative performance of the proposed regularizers in various scenarios.

Dongqi Fu, Yada Zhu, Hanghang Tong et al.

Understanding the causal interaction of time series variables can contribute to time series data analysis for many real-world applications, such as climate forecasting and extreme weather alerts. However, causal relationships are difficult to be fully observed in real-world complex settings, such as spatial-temporal data from deployed sensor networks. Therefore, to capture fine-grained causal relations among spatial-temporal variables for further a more accurate and reliable time series analysis, we first design a conceptual fine-grained causal model named TBN Granger Causality, which adds time-respecting Bayesian Networks to the previous time-lagged Neural Granger Causality to offset the instantaneous effects. Second, we propose an end-to-end deep generative model called TacSas, which discovers TBN Granger Causality in a generative manner to help forecast time series data and detect possible anomalies during the forecast. For evaluations, besides the causality discovery benchmark Lorenz-96, we also test TacSas on climate benchmark ERA5 for climate forecasting and the extreme weather benchmark of NOAA for extreme weather alerts.

Zihao Li, Xiao Lin, Zhining Liu et al.

While many advances in time series models focus exclusively on numerical data, research on multimodal time series, particularly those involving contextual textual information commonly encountered in real-world scenarios, remains in its infancy. With recent progress in large language models and time series learning, we revisit the integration of paired texts with time series through the Platonic Representation Hypothesis, which posits that representations of different modalities converge to shared spaces. In this context, we identify that time-series-paired texts may naturally exhibit periodic properties that closely mirror those of the original time series. Building on this insight, we propose a novel framework, Texts as Time Series (TaTS), which considers the time-series-paired texts to be auxiliary variables of the time series. TaTS can be plugged into any existing numerical-only time series models and enable them to handle time series data with paired texts effectively. Through extensive experiments on both multimodal time series forecasting and imputation tasks across benchmark datasets with various existing time series models, we demonstrate that TaTS can enhance predictive performance without modifying model architectures. Code available at https://github.com/iDEA-iSAIL-Lab-UIUC/TaTS.

Yuanchen Bei, Tianxin Wei, Xuying Ning et al.

Long-term memory is a critical capability for multimodal large language model (MLLM) agents, particularly in conversational settings where information accumulates and evolves over time. However, existing benchmarks either evaluate multi-session memory in text-only conversations or assess multimodal understanding within localized contexts, failing to evaluate how multimodal memory is preserved, organized, and evolved across long-term conversational trajectories. Thus, we introduce Mem-Gallery, a new benchmark for evaluating multimodal long-term conversational memory in MLLM agents. Mem-Gallery features high-quality multi-session conversations grounded in both visual and textual information, with long interaction horizons and rich multimodal dependencies. Building on this dataset, we propose a systematic evaluation framework that assesses key memory capabilities along three functional dimensions: memory extraction and test-time adaptation, memory reasoning, and memory knowledge management. Extensive benchmarking across thirteen memory systems reveals several key findings, highlighting the necessity of explicit multimodal information retention and memory organization, the persistent limitations in memory reasoning and knowledge management, as well as the efficiency bottleneck of current models.

Zhining Liu, Ze Yang, Xiao Lin et al.

Time-series forecasting plays a critical role in many real-world applications. Although increasingly powerful models have been developed and achieved superior results on benchmark datasets, through a fine-grained sample-level inspection, we find that (i) no single model consistently outperforms others across different test samples, but instead (ii) each model excels in specific cases. These findings prompt us to explore how to adaptively leverage the distinct strengths of various forecasting models for different samples. We introduce TimeFuse, a framework for collective time-series forecasting with sample-level adaptive fusion of heterogeneous models. TimeFuse utilizes meta-features to characterize input time series and trains a learnable fusor to predict optimal model fusion weights for any given input. The fusor can leverage samples from diverse datasets for joint training, allowing it to adapt to a wide variety of temporal patterns and thus generalize to new inputs, even from unseen datasets. Extensive experiments demonstrate the effectiveness of TimeFuse in various long-/short-term forecasting tasks, achieving near-universal improvement over the state-of-the-art individual models. Code is available at https://github.com/ZhiningLiu1998/TimeFuse.

Jiaru Zou, Dongqi Fu, Sirui Chen et al.

Retrieval-Augmented Generation (RAG) enhances Large Language Models (LLMs) by integrating them with an external knowledge base to improve the answer relevance and accuracy. In real-world scenarios, beyond pure text, a substantial amount of knowledge is stored in tables, and user questions often require retrieving answers that are distributed across multiple tables. Retrieving knowledge from a table corpora (i.e., various individual tables) for a question remains nascent, at least, for (i) how to understand intra- and inter-table knowledge effectively, (ii) how to filter unnecessary tables and how to retrieve the most relevant tables efficiently, (iii) how to prompt LLMs to infer over the retrieval, (iv) how to evaluate the corresponding performance in a realistic setting. Facing the above challenges, in this paper, we first propose a table-corpora-aware RAG framework, named T-RAG, which consists of the hierarchical memory index, multi-stage retrieval, and graph-aware prompting for effective and efficient table knowledge retrieval and inference. Further, we first develop a multi-table question answering benchmark named MultiTableQA, which spans 3 different task types, 57,193 tables, and 23,758 questions in total, and the sources are all from real-world scenarios. Based on MultiTableQA, we did the holistic comparison over table retrieval methods, RAG methods, and table-to-graph representation learning methods, where T-RAG shows the leading accuracy, recall, and running time performance. Also, under T-RAG, we evaluate the inference ability upgrade of different LLMs. Code and Data are available at https://github.com/jiaruzouu/T-RAG

Dongqi Fu, Yada Zhu, Zhining Liu et al.

Climate science studies the structure and dynamics of Earth's climate system and seeks to understand how climate changes over time, where the data is usually stored in the format of time series, recording the climate features, geolocation, time attributes, etc. Recently, much research attention has been paid to the climate benchmarks. In addition to the most common task of weather forecasting, several pioneering benchmark works are proposed for extending the modality, such as domain-specific applications like tropical cyclone intensity prediction and flash flood damage estimation, or climate statement and confidence level in the format of natural language. To further motivate the artificial general intelligence development for climate science, in this paper, we first contribute a multi-modal climate benchmark, i.e., ClimateBench-M, which aligns (1) the time series climate data from ERA5, (2) extreme weather events data from NOAA, and (3) satellite image data from NASA HLS based on a unified spatial-temporal granularity. Second, under each data modality, we also propose a simple but strong generative method that could produce competitive performance in weather forecasting, thunderstorm alerts, and crop segmentation tasks in the proposed ClimateBench-M. The data and code of ClimateBench-M are publicly available at https://github.com/iDEA-iSAIL-Lab-UIUC/ClimateBench-M.

Bo Yan, Weikai Lin, Yada Zhu et al.

Multi-turn jailbreak attacks progressively erode LLM safety alignment across seemingly innocuous conversation turns, achieving success rates exceeding 90% against state-of-the-art models. Existing alignment-based and guardrail methods suffer from three key limitations: they require costly weight modification, evaluate each turn independently without modeling cumulative safety erosion, and detect attacks only after harmful content has been generated. To address these limitations, we first formulate the proactive early jailbreak detection problem with a new metric, detection lead, that measures how early an attack can be detected before the LLM complies. We then propose SAFEDREAM, a lightweight world-model-based framework that operates as an external module without modifying the LLM's weights. SAFEDREAM introduces three components: (1) a safety state world model that encodes LLM hidden states into a compact safety representation and predicts how it evolves across turns, (2) CUSUM detection that accumulates weak per-turn risk signals into reliable evidence, and (3) contrastive imagination that simultaneously rolls out attack and benign futures in latent space to issue early alarms before jailbreaks occur. On three multi-turn jailbreak benchmarks (XGuard-Train, SafeDialBench, SafeMTData) against 8 baselines, SAFEDREAM achieves the best detection timeliness across all benchmarks (1.06-1.20 turns before compliance) while maintaining competitive false positive rates and outperforming baselines in detection quality.

Zhining Liu, Zihao Li, Ze Yang et al.

Class-imbalanced learning (CIL) on tabular data is important in many real-world applications where the minority class holds the critical but rare outcomes. In this paper, we present CLIMB, a comprehensive benchmark for class-imbalanced learning on tabular data. CLIMB includes 73 real-world datasets across diverse domains and imbalance levels, along with unified implementations of 29 representative CIL algorithms. Built on a high-quality open-source Python package with unified API designs, detailed documentation, and rigorous code quality controls, CLIMB supports easy implementation and comparison between different CIL algorithms. Through extensive experiments, we provide practical insights on method accuracy and efficiency, highlighting the limitations of naive rebalancing, the effectiveness of ensembles, and the importance of data quality. Our code, documentation, and examples are available at https://github.com/ZhiningLiu1998/imbalanced-ensemble.

Junhong Lin, Bing Zhang, Song Wang et al.

Large language models (LLMs) continue to struggle with knowledge-intensive questions that require up-to-date information and multi-hop reasoning. Augmenting LLMs with hybrid external knowledge, such as unstructured text and structured knowledge graphs, offers a promising alternative to costly continual pretraining. As such, reliable evaluation of their retrieval and reasoning capabilities becomes critical. However, many existing benchmarks increasingly overlap with LLM pretraining data, which means answers or supporting knowledge may already be encoded in model parameters, making it difficult to distinguish genuine retrieval and reasoning from parametric recall. We introduce HybridRAG-Bench, a framework for constructing benchmarks to evaluate retrieval-intensive, multi-hop reasoning over hybrid knowledge. HybridRAG-Bench automatically couples unstructured text and structured knowledge graph representations derived from recent scientific literature on arXiv, and generates knowledge-intensive question-answer pairs grounded in explicit reasoning paths. The framework supports flexible domain and time-frame selection, enabling contamination-aware and customizable evaluation as models and knowledge evolve. Experiments across three domains (artificial intelligence, governance and policy, and bioinformatics) demonstrate that HybridRAG-Bench rewards genuine retrieval and reasoning rather than parametric recall, offering a principled testbed for evaluating hybrid knowledge-augmented reasoning systems. We release our code and data at github.com/junhongmit/HybridRAG-Bench.

Jinyeop Song, Song Wang, Julian Shun et al.

Knowledge-graph retrieval-augmented generation (KG-RAG) couples large language models (LLMs) with structured, verifiable knowledge graphs (KGs) to reduce hallucinations and expose reasoning traces. However, many KG-RAG systems compose multiple LLM modules (e.g planning, reasoning, and responding), inflating inference cost and binding behavior to a specific target KG. To address this, we introduce KG-R1, an agentic KG retrieval-augmented generation (KG-RAG) framework through reinforcement learning (RL). KG-R1 utilizes a single agent that interacts with KGs as its environment, learning to retrieve at each step and incorporating the retrieved information into its reasoning and generation. The process is optimized through end-to-end RL. In controlled experiments across Knowledge-Graph Question Answering (KGQA) benchmarks, our method demonstrates both efficiency and transferability: Using Qwen-2.5-3B, KG-R1 improves answer accuracy with fewer generation tokens than prior multi-module workflow methods that use larger foundation or fine-tuned models. Furthermore, KG-R1 enables plug and play: after training, it maintains strong accuracy on new KGs without modification. These properties make KG-R1 a promising KG-RAG framework for real-world deployment. Our code is publicly available at https://github.com/Jinyeop3110/KG-R1.

Junhong Lin, Song Wang, Xiaojie Guo et al.

Large language models (LLMs) excel at many language understanding tasks but struggle to reason over knowledge that evolves. To address this, recent work has explored augmenting LLMs with knowledge graphs (KGs) to provide structured, up-to-date information. However, many existing approaches assume a static snapshot of the KG and overlook the temporal dynamics and factual inconsistencies inherent in real-world data. To address the challenge of reasoning over temporally shifting knowledge, we propose EvoReasoner, a temporal-aware multi-hop reasoning algorithm that performs global-local entity grounding, multi-route decomposition, and temporally grounded scoring. To ensure that the underlying KG remains accurate and up-to-date, we introduce EvoKG, a noise-tolerant KG evolution module that incrementally updates the KG from unstructured documents through confidence-based contradiction resolution and temporal trend tracking. We evaluate our approach on temporal QA benchmarks and a novel end-to-end setting where the KG is dynamically updated from raw documents. Our method outperforms both prompting-based and KG-enhanced baselines, effectively narrowing the gap between small and large LLMs on dynamic question answering. Notably, an 8B-parameter model using our approach matches the performance of a 671B model prompted seven months later. These results highlight the importance of combining temporal reasoning with KG evolution for robust and up-to-date LLM performance. Our code is publicly available at github.com/junhongmit/TREK.

Zhining Liu, Ruizhong Qiu, Zhichen Zeng et al.

Data collected in the real world often encapsulates historical discrimination against disadvantaged groups and individuals. Existing fair machine learning (FairML) research has predominantly focused on mitigating discriminative bias in the model prediction, with far less effort dedicated towards exploring how to trace biases present in the data, despite its importance for the transparency and interpretability of FairML. To fill this gap, we investigate a novel research problem: discovering samples that reflect biases/prejudices from the training data. Grounding on the existing fairness notions, we lay out a sample bias criterion and propose practical algorithms for measuring and countering sample bias. The derived bias score provides intuitive sample-level attribution and explanation of historical bias in data. On this basis, we further design two FairML strategies via sample-bias-informed minimal data editing. They can mitigate both group and individual unfairness at the cost of minimal or zero predictive utility loss. Extensive experiments and analyses on multiple real-world datasets demonstrate the effectiveness of our methods in explaining and mitigating unfairness. Code is available at https://github.com/ZhiningLiu1998/AIM.

Shengyu Feng, Baoyu Jing, Yada Zhu et al.

Contrastive learning is an effective unsupervised method in graph representation learning. Recently, the data augmentation based contrastive learning method has been extended from images to graphs. However, most prior works are directly adapted from the models designed for images. Unlike the data augmentation on images, the data augmentation on graphs is far less intuitive and much harder to provide high-quality contrastive samples, which are the key to the performance of contrastive learning models. This leaves much space for improvement over the existing graph contrastive learning frameworks. In this work, by introducing an adversarial graph view and an information regularizer, we propose a simple but effective method, Adversarial Graph Contrastive Learning (ARIEL), to extract informative contrastive samples within a reasonable constraint. It consistently outperforms the current graph contrastive learning methods in the node classification task over various real-world datasets and further improves the robustness of graph contrastive learning. The code is at https://github.com/Shengyu-Feng/ARIEL.

Junhong Lin, Xiaojie Guo, Shuaicheng Zhang et al.

Graph mining has become crucial in fields such as social science, finance, and cybersecurity. Many large-scale real-world networks exhibit both heterogeneity, where multiple node and edge types exist in the graph, and heterophily, where connected nodes may have dissimilar labels and attributes. However, existing benchmarks primarily focus on either heterophilic homogeneous graphs or homophilic heterogeneous graphs, leaving a significant gap in understanding how models perform on graphs with both heterogeneity and heterophily. To bridge this gap, we introduce H2GB, a large-scale node-classification graph benchmark that brings together the complexities of both the heterophily and heterogeneity properties of real-world graphs. H2GB encompasses 9 real-world datasets spanning 5 diverse domains, 28 baseline models, and a unified benchmarking library with a standardized data loader, evaluator, unified modeling framework, and an extensible framework for reproducibility. We establish a standardized workflow supporting both model selection and development, enabling researchers to easily benchmark graph learning methods. Extensive experiments across 28 baselines reveal that current methods struggle with heterophilic and heterogeneous graphs, underscoring the need for improved approaches. Finally, we present a new variant of the model, H2G-former, developed following our standardized workflow, that excels at this challenging benchmark. Both the benchmark and the framework are publicly available at Github and PyPI, with documentation hosted at https://junhongmit.github.io/H2GB.

Song Wang, Junhong Lin, Xiaojie Guo et al.

While large language models (LLMs) have made significant progress in processing and reasoning over knowledge graphs, current methods suffer from a high non-retrieval rate. This limitation reduces the accuracy of answering questions based on these graphs. Our analysis reveals that the combination of greedy search and forward reasoning is a major contributor to this issue. To overcome these challenges, we introduce the concept of super-relations, which enables both forward and backward reasoning by summarizing and connecting various relational paths within the graph. This holistic approach not only expands the search space, but also significantly improves retrieval efficiency. In this paper, we propose the ReKnoS framework, which aims to Reason over Knowledge Graphs with Super-Relations. Our framework's key advantages include the inclusion of multiple relation paths through super-relations, enhanced forward and backward reasoning capabilities, and increased efficiency in querying LLMs. These enhancements collectively lead to a substantial improvement in the successful retrieval rate and overall reasoning performance. We conduct extensive experiments on nine real-world datasets to evaluate ReKnoS, and the results demonstrate the superior performance of ReKnoS over existing state-of-the-art baselines, with an average accuracy gain of 2.92%.

Yikun Ban, Ishika Agarwal, Ziwei Wu et al.

We study both stream-based and pool-based active learning with neural network approximations. A recent line of works proposed bandit-based approaches that transformed active learning into a bandit problem, achieving both theoretical and empirical success. However, the performance and computational costs of these methods may be susceptible to the number of classes, denoted as $K$, due to this transformation. Therefore, this paper seeks to answer the question: "How can we mitigate the adverse impacts of $K$ while retaining the advantages of principled exploration and provable performance guarantees in active learning?" To tackle this challenge, we propose two algorithms based on the newly designed exploitation and exploration neural networks for stream-based and pool-based active learning. Subsequently, we provide theoretical performance guarantees for both algorithms in a non-parametric setting, demonstrating a slower error-growth rate concerning $K$ for the proposed approaches. We use extensive experiments to evaluate the proposed algorithms, which consistently outperform state-of-the-art baselines.

Yue Zhou, Yada Zhu, Diego Antognini et al.

This paper studies the relationship between the surface form of a mathematical problem and its solvability by large language models. We find that subtle alterations in the surface form can significantly impact the answer distribution and the solve rate, exposing the language model's lack of robustness and sensitivity to the surface form in reasoning through complex problems. To improve mathematical reasoning performance, we propose Self-Consistency-over-Paraphrases (SCoP), which diversifies reasoning paths from specific surface forms of the problem. We evaluate our approach on four mathematics reasoning benchmarks over three large language models and show that SCoP improves mathematical reasoning performance over vanilla self-consistency, particularly for problems initially deemed unsolvable. Finally, we provide additional experiments and discussion regarding problem difficulty and surface forms, including cross-model difficulty agreement and paraphrasing transferability, and Variance of Variations (VOV) for language model evaluation.

Bing Zhang, Mikio Takeuchi, Ryo Kawahara et al.

The advancement of large language models (LLMs) has led to a greater challenge of having a rigorous and systematic evaluation of complex tasks performed, especially in enterprise applications. Therefore, LLMs need to be able to benchmark enterprise datasets for various tasks. This work presents a systematic exploration of benchmarking strategies tailored to LLM evaluation, focusing on the utilization of domain-specific datasets and consisting of a variety of NLP tasks. The proposed evaluation framework encompasses 25 publicly available datasets from diverse enterprise domains like financial services, legal, cyber security, and climate and sustainability. The diverse performance of 13 models across different enterprise tasks highlights the importance of selecting the right model based on the specific requirements of each task. Code and prompts are available on GitHub.

Shuaicheng Zhang, Haohui Wang, Junhong Lin et al.

Graph heterophily, where connected nodes have different labels, has attracted significant interest recently. Most existing works adopt a simplified approach - using low-pass filters for homophilic graphs and high-pass filters for heterophilic graphs. However, we discover that the relationship between graph heterophily and spectral filters is more complex - the optimal filter response varies across frequency components and does not follow a strict monotonic correlation with heterophily degree. This finding challenges conventional fixed filter designs and suggests the need for adaptive filtering to preserve expressiveness in graph embeddings. Formally, natural questions arise: Given a heterophilic graph G, how and to what extent will the varying heterophily degree of G affect the performance of GNNs? How can we design adaptive filters to fit those varying heterophilic connections? Our theoretical analysis reveals that the average frequency response of GNNs and graph heterophily degree do not follow a strict monotonic correlation, necessitating adaptive graph filters to guarantee good generalization performance. Hence, we propose [METHOD NAME], a simple yet powerful GNN, which extracts information across the heterophily spectrum and combines salient representations through adaptive mixing. [METHOD NAME]'s superior performance achieves up to 9.2% accuracy improvement over leading baselines across homophilic and heterophilic graphs.

Wei Fang, Yang Zhang, Kaizhi Qian et al.

Large language models (LLMs) are increasingly integrated with specialized external tools, yet many tasks demand zero-shot tool usage with minimal or noisy documentation. Existing solutions rely on manual rewriting or labeled data for validation, making them inapplicable in true zero-shot settings. To address these challenges, we propose PLAY2PROMPT, an automated framework that systematically "plays" with each tool to explore its input-output behaviors. Through this iterative trial-and-error process, PLAY2PROMPT refines tool documentation and generates usage examples without any labeled data. These examples not only guide LLM inference but also serve as validation to further enhance tool utilization. Extensive experiments on real-world tasks demonstrate that PLAY2PROMPT significantly improves zero-shot tool performance across both open and closed models, offering a scalable and effective solution for domain-specific tool integration.

Dingsu Wang, Yuchen Yan, Ruizhong Qiu et al.

Multivariate time series (MTS) imputation is a widely studied problem in recent years. Existing methods can be divided into two main groups, including (1) deep recurrent or generative models that primarily focus on time series features, and (2) graph neural networks (GNNs) based models that utilize the topological information from the inherent graph structure of MTS as relational inductive bias for imputation. Nevertheless, these methods either neglect topological information or assume the graph structure is fixed and accurately known. Thus, they fail to fully utilize the graph dynamics for precise imputation in more challenging MTS data such as networked time series (NTS), where the underlying graph is constantly changing and might have missing edges. In this paper, we propose a novel approach to overcome these limitations. First, we define the problem of imputation over NTS which contains missing values in both node time series features and graph structures. Then, we design a new model named PoGeVon which leverages variational autoencoder (VAE) to predict missing values over both node time series features and graph structures. In particular, we propose a new node position embedding based on random walk with restart (RWR) in the encoder with provable higher expressive power compared with message-passing based graph neural networks (GNNs). We further design a decoder with 3-stage predictions from the perspective of multi-task learning to impute missing values in both time series and graph structures reciprocally. Experiment results demonstrate the effectiveness of our model over baselines.

Haohui Wang, Baoyu Jing, Kaize Ding et al.

In the context of long-tail classification on graphs, the vast majority of existing work primarily revolves around the development of model debiasing strategies, intending to mitigate class imbalances and enhance the overall performance. Despite the notable success, there is very limited literature that provides a theoretical tool for characterizing the behaviors of long-tail classes in graphs and gaining insight into generalization performance in real-world scenarios. To bridge this gap, we propose a generalization bound for long-tail classification on graphs by formulating the problem in the fashion of multi-task learning, i.e., each task corresponds to the prediction of one particular class. Our theoretical results show that the generalization performance of long-tail classification is dominated by the overall loss range and the task complexity. Building upon the theoretical findings, we propose a novel generic framework HierTail for long-tail classification on graphs. In particular, we start with a hierarchical task grouping module that allows us to assign related tasks into hypertasks and thus control the complexity of the task space; then, we further design a balanced contrastive learning module to adaptively balance the gradients of both head and tail classes to control the loss range across all tasks in a unified fashion. Extensive experiments demonstrate the effectiveness of HierTail in characterizing long-tail classes on real graphs, which achieves up to 12.9% improvement over the leading baseline method in accuracy.

Zixuan Yuan, Yada Zhu, Wei Zhang et al.

Earnings call (EC), as a periodic teleconference of a publicly-traded company, has been extensively studied as an essential market indicator because of its high analytical value in corporate fundamentals. The recent emergence of deep learning techniques has shown great promise in creating automated pipelines to benefit the EC-supported financial applications. However, these methods presume all included contents to be informative without refining valuable semantics from long-text transcript and suffer from EC scarcity issue. Meanwhile, these black-box methods possess inherent difficulties in providing human-understandable explanations. To this end, in this paper, we propose a Multi-Domain Transformer-Based Counterfactual Augmentation, named MTCA, to address the above problems. Specifically, we first propose a transformer-based EC encoder to attentively quantify the task-inspired significance of critical EC content for market inference. Then, a multi-domain counterfactual learning framework is developed to evaluate the gradient-based variations after we perturb limited EC informative texts with plentiful cross-domain documents, enabling MTCA to perform unsupervised data augmentation. As a bonus, we discover a way to use non-training data as instance-based explanations for which we show the result with case studies. Extensive experiments on the real-world financial datasets demonstrate the effectiveness of interpretable MTCA for improving the volatility evaluation ability of the state-of-the-art by 14.2\% in accuracy.

Wei Zhang, Ziming Huang, Yada Zhu et al.

In the recent advances of natural language processing, the scale of the state-of-the-art models and datasets is usually extensive, which challenges the application of sample-based explanation methods in many aspects, such as explanation interpretability, efficiency, and faithfulness. In this work, for the first time, we can improve the interpretability of explanations by allowing arbitrary text sequences as the explanation unit. On top of this, we implement a hessian-free method with a model faithfulness guarantee. Finally, to compare our method with the others, we propose a semantic-based evaluation metric that can better align with humans' judgment of explanations than the widely adopted diagnostic or re-training measures. The empirical results on multiple real data sets demonstrate the proposed method's superior performance to popular explanation techniques such as Influence Function or TracIn on semantic evaluation.

Lecheng Zheng, Jinjun Xiong, Yada Zhu et al.

With the advent of big data across multiple high-impact applications, we are often facing the challenge of complex heterogeneity. The newly collected data usually consist of multiple modalities and are characterized with multiple labels, thus exhibiting the co-existence of multiple types of heterogeneity. Although state-of-the-art techniques are good at modeling complex heterogeneity with sufficient label information, such label information can be quite expensive to obtain in real applications. Recently, researchers pay great attention to contrastive learning due to its prominent performance by utilizing rich unlabeled data. However, existing work on contrastive learning is not able to address the problem of false negative pairs, i.e., some `negative' pairs may have similar representations if they have the same label. To overcome the issues, in this paper, we propose a unified heterogeneous learning framework, which combines both the weighted unsupervised contrastive loss and the weighted supervised contrastive loss to model multiple types of heterogeneity. We first provide a theoretical analysis showing that the vanilla contrastive learning loss easily leads to the sub-optimal solution in the presence of false negative pairs, whereas the proposed weighted loss could automatically adjust the weight based on the similarity of the learned representations to mitigate this issue. Experimental results on real-world data sets demonstrate the effectiveness and the efficiency of the proposed framework modeling multiple types of heterogeneity.

Baoyu Jing, Hanghang Tong, Yada Zhu

Co-evolving time series appears in a multitude of applications such as environmental monitoring, financial analysis, and smart transportation. This paper aims to address the following challenges, including (C1) how to incorporate explicit relationship networks of the time series; (C2) how to model the implicit relationship of the temporal dynamics. We propose a novel model called Network of Tensor Time Series, which is comprised of two modules, including Tensor Graph Convolutional Network (TGCN) and Tensor Recurrent Neural Network (TRNN). TGCN tackles the first challenge by generalizing Graph Convolutional Network (GCN) for flat graphs to tensor graphs, which captures the synergy between multiple graphs associated with the tensors. TRNN leverages tensor decomposition to model the implicit relationships among co-evolving time series. The experimental results on five real-world datasets demonstrate the efficacy of the proposed method.

Yunan Ye, Hengzhi Pei, Boxin Wang et al.

Portfolio management (PM) is a fundamental financial planning task that aims to achieve investment goals such as maximal profits or minimal risks. Its decision process involves continuous derivation of valuable information from various data sources and sequential decision optimization, which is a prospective research direction for reinforcement learning (RL). In this paper, we propose SARL, a novel State-Augmented RL framework for PM. Our framework aims to address two unique challenges in financial PM: (1) data heterogeneity -- the collected information for each asset is usually diverse, noisy and imbalanced (e.g., news articles); and (2) environment uncertainty -- the financial market is versatile and non-stationary. To incorporate heterogeneous data and enhance robustness against environment uncertainty, our SARL augments the asset information with their price movement prediction as additional states, where the prediction can be solely based on financial data (e.g., asset prices) or derived from alternative sources such as news. Experiments on two real-world datasets, (i) Bitcoin market and (ii) HighTech stock market with 7-year Reuters news articles, validate the effectiveness of SARL over existing PM approaches, both in terms of accumulated profits and risk-adjusted profits. Moreover, extensive simulations are conducted to demonstrate the importance of our proposed state augmentation, providing new insights and boosting performance significantly over standard RL-based PM method and other baselines.

Di Chen, Yada Zhu, Xiaodong Cui et al.

Real-world applications often involve domain-specific and task-based performance objectives that are not captured by the standard machine learning losses, but are critical for decision making. A key challenge for direct integration of more meaningful domain and task-based evaluation criteria into an end-to-end gradient-based training process is the fact that often such performance objectives are not necessarily differentiable and may even require additional decision-making optimization processing. We propose the Task-Oriented Prediction Network (TOPNet), an end-to-end learning scheme that automatically integrates task-based evaluation criteria into the learning process via a learnable surrogate loss function, which directly guides the model towards the task-based goal. A major benefit of the proposed TOPNet learning scheme lies in its capability of automatically integrating non-differentiable evaluation criteria, which makes it particularly suitable for diversified and customized task-based evaluation criteria in real-world tasks. We validate the performance of TOPNet on two real-world financial prediction tasks, revenue surprise forecasting and credit risk modeling. The experimental results demonstrate that TOPNet significantly outperforms both traditional modeling with standard losses and modeling with hand-crafted heuristic differentiable surrogate losses.