Christos Faloutsos

Costas Mavromatis, Vassilis N. Ioannidis, Shen Wang et al. · amazon-science

How can we learn effective node representations on textual graphs? Graph Neural Networks (GNNs) that use Language Models (LMs) to encode textual information of graphs achieve state-of-the-art performance in many node classification tasks. Yet, combining GNNs with LMs has not been widely explored for practical deployments due to its scalability issues. In this work, we tackle this challenge by developing a Graph-Aware Distillation framework (GRAD) to encode graph structures into an LM for graph-free, fast inference. Different from conventional knowledge distillation, GRAD jointly optimizes a GNN teacher and a graph-free student over the graph's nodes via a shared LM. This encourages the graph-free student to exploit graph information encoded by the GNN teacher while at the same time, enables the GNN teacher to better leverage textual information from unlabeled nodes. As a result, the teacher and the student models learn from each other to improve their overall performance. Experiments in eight node classification benchmarks in both transductive and inductive settings showcase GRAD's superiority over existing distillation approaches for textual graphs.

Xinyang Zhang, Chenwei Zhang, Xian Li et al. · amazon-science

Automatic extraction of product attributes from their textual descriptions is essential for online shopper experience. One inherent challenge of this task is the emerging nature of e-commerce products -- we see new types of products with their unique set of new attributes constantly. Most prior works on this matter mine new values for a set of known attributes but cannot handle new attributes that arose from constantly changing data. In this work, we study the attribute mining problem in an open-world setting to extract novel attributes and their values. Instead of providing comprehensive training data, the user only needs to provide a few examples for a few known attribute types as weak supervision. We propose a principled framework that first generates attribute value candidates and then groups them into clusters of attributes. The candidate generation step probes a pre-trained language model to extract phrases from product titles. Then, an attribute-aware fine-tuning method optimizes a multitask objective and shapes the language model representation to be attribute-discriminative. Finally, we discover new attributes and values through the self-ensemble of our framework, which handles the open-world challenge. We run extensive experiments on a large distantly annotated development set and a gold standard human-annotated test set that we collected. Our model significantly outperforms strong baselines and can generalize to unseen attributes and product types.

Elvin Johnson, Shreshta Mohan, Alex Gaudio et al.

Advances in data-driven deep learning for chest X-ray image analysis underscore the need for explainability, privacy, large datasets and significant computational resources. We frame privacy and explainability as a lossy single-image compression problem to reduce both computational and data requirements without training. For Cardiomegaly detection in chest X-ray images, we propose HeartSpot and four spatial bias priors. HeartSpot priors define how to sample pixels based on domain knowledge from medical literature and from machines. HeartSpot privatizes chest X-ray images by discarding up to 97% of pixels, such as those that reveal the shape of the thoracic cage, bones, small lesions and other sensitive features. HeartSpot priors are ante-hoc explainable and give a human-interpretable image of the preserved spatial features that clearly outlines the heart. HeartSpot offers strong compression, with up to 32x fewer pixels and 11x smaller filesize. Cardiomegaly detectors using HeartSpot are up to 9x faster to train or at least as accurate (up to +.01 AUC ROC) when compared to a baseline DenseNet121. HeartSpot is post-hoc explainable by re-using existing attribution methods without requiring access to the original non-privatized image. In summary, HeartSpot improves speed and accuracy, reduces image size, improves privacy and ensures explainability. Source code: https://www.github.com/adgaudio/HeartSpot

Hengrui Zhang, Jiani Zhang, Balasubramaniam Srinivasan et al.

Recent advances in tabular data generation have greatly enhanced synthetic data quality. However, extending diffusion models to tabular data is challenging due to the intricately varied distributions and a blend of data types of tabular data. This paper introduces Tabsyn, a methodology that synthesizes tabular data by leveraging a diffusion model within a variational autoencoder (VAE) crafted latent space. The key advantages of the proposed Tabsyn include (1) Generality: the ability to handle a broad spectrum of data types by converting them into a single unified space and explicitly capture inter-column relations; (2) Quality: optimizing the distribution of latent embeddings to enhance the subsequent training of diffusion models, which helps generate high-quality synthetic data, (3) Speed: much fewer number of reverse steps and faster synthesis speed than existing diffusion-based methods. Extensive experiments on six datasets with five metrics demonstrate that Tabsyn outperforms existing methods. Specifically, it reduces the error rates by 86% and 67% for column-wise distribution and pair-wise column correlation estimations compared with the most competitive baselines.

Shichang Zhang, Jiani Zhang, Xiang Song et al.

Transparency and accountability have become major concerns for black-box machine learning (ML) models. Proper explanations for the model behavior increase model transparency and help researchers develop more accountable models. Graph neural networks (GNN) have recently shown superior performance in many graph ML problems than traditional methods, and explaining them has attracted increased interest. However, GNN explanation for link prediction (LP) is lacking in the literature. LP is an essential GNN task and corresponds to web applications like recommendation and sponsored search on web. Given existing GNN explanation methods only address node/graph-level tasks, we propose Path-based GNN Explanation for heterogeneous Link prediction (PaGE-Link) that generates explanations with connection interpretability, enjoys model scalability, and handles graph heterogeneity. Qualitatively, PaGE-Link can generate explanations as paths connecting a node pair, which naturally captures connections between the two nodes and easily transfer to human-interpretable explanations. Quantitatively, explanations generated by PaGE-Link improve AUC for recommendation on citation and user-item graphs by 9 - 35% and are chosen as better by 78.79% of responses in human evaluation.

Namyong Park, Ryan Rossi, Eunyee Koh et al.

Given entities and their interactions in the web data, which may have occurred at different time, how can we find communities of entities and track their evolution? In this paper, we approach this important task from graph clustering perspective. Recently, state-of-the-art clustering performance in various domains has been achieved by deep clustering methods. Especially, deep graph clustering (DGC) methods have successfully extended deep clustering to graph-structured data by learning node representations and cluster assignments in a joint optimization framework. Despite some differences in modeling choices (e.g., encoder architectures), existing DGC methods are mainly based on autoencoders and use the same clustering objective with relatively minor adaptations. Also, while many real-world graphs are dynamic, previous DGC methods considered only static graphs. In this work, we develop CGC, a novel end-to-end framework for graph clustering, which fundamentally differs from existing methods. CGC learns node embeddings and cluster assignments in a contrastive graph learning framework, where positive and negative samples are carefully selected in a multi-level scheme such that they reflect hierarchical community structures and network homophily. Also, we extend CGC for time-evolving data, where temporal graph clustering is performed in an incremental learning fashion, with the ability to detect change points. Extensive evaluation on real-world graphs demonstrates that the proposed CGC consistently outperforms existing methods.

Jiacheng Li, Tong Zhao, Jin Li et al.

Sequential recommendation aims to model dynamic user behavior from historical interactions. Self-attentive methods have proven effective at capturing short-term dynamics and long-term preferences. Despite their success, these approaches still struggle to model sparse data, on which they struggle to learn high-quality item representations. We propose to model user dynamics from shopping intents and interacted items simultaneously. The learned intents are coarse-grained and work as prior knowledge for item recommendation. To this end, we present a coarse-to-fine self-attention framework, namely CaFe, which explicitly learns coarse-grained and fine-grained sequential dynamics. Specifically, CaFe first learns intents from coarse-grained sequences which are dense and hence provide high-quality user intent representations. Then, CaFe fuses intent representations into item encoder outputs to obtain improved item representations. Finally, we infer recommended items based on representations of items and corresponding intents. Experiments on sparse datasets show that CaFe outperforms state-of-the-art self-attentive recommenders by 44.03% NDCG@5 on average.

Costas Mavromatis, Balasubramaniam Srinivasan, Zhengyuan Shen et al.

Large Language Models (LLMs) can adapt to new tasks via in-context learning (ICL). ICL is efficient as it does not require any parameter updates to the trained LLM, but only few annotated examples as input for the LLM. In this work, we investigate an active learning approach for ICL, where there is a limited budget for annotating examples. We propose a model-adaptive optimization-free algorithm, termed AdaICL, which identifies examples that the model is uncertain about, and performs semantic diversity-based example selection. Diversity-based sampling improves overall effectiveness, while uncertainty sampling improves budget efficiency and helps the LLM learn new information. Moreover, AdaICL poses its sampling strategy as a Maximum Coverage problem, that dynamically adapts based on the model's feedback and can be approximately solved via greedy algorithms. Extensive experiments on nine datasets and seven LLMs show that AdaICL improves performance by 4.4% accuracy points over SOTA (7.7% relative improvement), is up to 3x more budget-efficient than performing annotations uniformly at random, while it outperforms SOTA with 2x fewer ICL examples.

Jing Zhu, Xiang Song, Vassilis N. Ioannidis et al.

How can we enhance the node features acquired from Pretrained Models (PMs) to better suit downstream graph learning tasks? Graph Neural Networks (GNNs) have become the state-of-the-art approach for many high-impact, real-world graph applications. For feature-rich graphs, a prevalent practice involves utilizing a PM directly to generate features, without incorporating any domain adaptation techniques. Nevertheless, this practice is suboptimal because the node features extracted from PM are graph-agnostic and prevent GNNs from fully utilizing the potential correlations between the graph structure and node features, leading to a decline in GNNs performance. In this work, we seek to improve the node features obtained from a PM for downstream graph tasks and introduce TOUCHUP-G, which has several advantages. It is (a) General: applicable to any downstream graph task, including link prediction which is often employed in recommender systems; (b) Multi-modal: able to improve raw features of any modality (e.g. images, texts, audio); (c) Principled: it is closely related to a novel metric, feature homophily, which we propose to quantify the potential correlations between the graph structure and node features and we show that TOUCHUP-G can effectively shrink the discrepancy between the graph structure and node features; (d) Effective: achieving state-of-the-art results on four real-world datasets spanning different tasks and modalities.

Jaemin Yoo, Meng-Chieh Lee, Shubhranshu Shekhar et al.

How can we solve semi-supervised node classification in various graphs possibly with noisy features and structures? Graph neural networks (GNNs) have succeeded in many graph mining tasks, but their generalizability to various graph scenarios is limited due to the difficulty of training, hyperparameter tuning, and the selection of a model itself. Einstein said that we should "make everything as simple as possible, but not simpler." We rephrase it into the careful simplicity principle: a carefully-designed simple model can surpass sophisticated ones in real-world graphs. Based on the principle, we propose SlimG for semi-supervised node classification, which exhibits four desirable properties: It is (a) accurate, winning or tying on 10 out of 13 real-world datasets; (b) robust, being the only one that handles all scenarios of graph data (homophily, heterophily, random structure, noisy features, etc.); (c) fast and scalable, showing up to 18 times faster training in million-scale graphs; and (d) interpretable, thanks to the linearity and sparsity. We explain the success of SlimG through a systematic study of the designs of existing GNNs, sanity checks, and comprehensive ablation studies.

Zijie Huang, Daheng Wang, Binxuan Huang et al.

Knowledge graph embeddings (KGE) have been extensively studied to embed large-scale relational data for many real-world applications. Existing methods have long ignored the fact many KGs contain two fundamentally different views: high-level ontology-view concepts and fine-grained instance-view entities. They usually embed all nodes as vectors in one latent space. However, a single geometric representation fails to capture the structural differences between two views and lacks probabilistic semantics towards concepts' granularity. We propose Concept2Box, a novel approach that jointly embeds the two views of a KG using dual geometric representations. We model concepts with box embeddings, which learn the hierarchy structure and complex relations such as overlap and disjoint among them. Box volumes can be interpreted as concepts' granularity. Different from concepts, we model entities as vectors. To bridge the gap between concept box embeddings and entity vector embeddings, we propose a novel vector-to-box distance metric and learn both embeddings jointly. Experiments on both the public DBpedia KG and a newly-created industrial KG showed the effectiveness of Concept2Box.

Namyong Park, Ryan Rossi, Nesreen Ahmed et al.

Given a graph learning task, such as link prediction, on a new graph, how can we select the best method as well as its hyperparameters (collectively called a model) without having to train or evaluate any model on the new graph? Model selection for graph learning has been largely ad hoc. A typical approach has been to apply popular methods to new datasets, but this is often suboptimal. On the other hand, systematically comparing models on the new graph quickly becomes too costly, or even impractical. In this work, we develop the first meta-learning approach for evaluation-free graph learning model selection, called MetaGL, which utilizes the prior performances of existing methods on various benchmark graph datasets to automatically select an effective model for the new graph, without any model training or evaluations. To quantify similarities across a wide variety of graphs, we introduce specialized meta-graph features that capture the structural characteristics of a graph. Then we design G-M network, which represents the relations among graphs and models, and develop a graph-based meta-learner operating on this G-M network, which estimates the relevance of each model to different graphs. Extensive experiments show that using MetaGL to select a model for the new graph greatly outperforms several existing meta-learning techniques tailored for graph learning model selection (up to 47% better), while being extremely fast at test time (~1 sec).

Hengrui Zhang, Shen Wang, Vassilis N. Ioannidis et al.

Graph Neural Networks (GNNs) are currently dominating in modeling graph-structure data, while their high reliance on graph structure for inference significantly impedes them from widespread applications. By contrast, Graph-regularized MLPs (GR-MLPs) implicitly inject the graph structure information into model weights, while their performance can hardly match that of GNNs in most tasks. This motivates us to study the causes of the limited performance of GR-MLPs. In this paper, we first demonstrate that node embeddings learned from conventional GR-MLPs suffer from dimensional collapse, a phenomenon in which the largest a few eigenvalues dominate the embedding space, through empirical observations and theoretical analysis. As a result, the expressive power of the learned node representations is constrained. We further propose OrthoReg, a novel GR-MLP model to mitigate the dimensional collapse issue. Through a soft regularization loss on the correlation matrix of node embeddings, OrthoReg explicitly encourages orthogonal node representations and thus can naturally avoid dimensionally collapsed representations. Experiments on traditional transductive semi-supervised classification tasks and inductive node classification for cold-start scenarios demonstrate its effectiveness and superiority.

Alex Gaudio, Christos Faloutsos, Asim Smailagic et al.

Is there an initialization for deep networks that requires no learning? ExplainFix adopts two design principles: the "fixed filters" principle that all spatial filter weights of convolutional neural networks can be fixed at initialization and never learned, and the "nimbleness" principle that only few network parameters suffice. We contribute (a) visual model-based explanations, (b) speed and accuracy gains, and (c) novel tools for deep convolutional neural networks. ExplainFix gives key insights that spatially fixed networks should have a steered initialization, that spatial convolution layers tend to prioritize low frequencies, and that most network parameters are not necessary in spatially fixed models. ExplainFix models have up to 100x fewer spatial filter kernels than fully learned models and matching or improved accuracy. Our extensive empirical analysis confirms that ExplainFix guarantees nimbler models (train up to 17\% faster with channel pruning), matching or improved predictive performance (spanning 13 distinct baseline models, four architectures and two medical image datasets), improved robustness to larger learning rate, and robustness to varying model size. We are first to demonstrate that all spatial filters in state-of-the-art convolutional deep networks can be fixed at initialization, not learned.

Meng-Chieh Lee, Shubhranshu Shekhar, Jaemin Yoo et al.

Given a large graph with few node labels, how can we (a) identify whether there is generalized network-effects (GNE) or not, (b) estimate GNE to explain the interrelations among node classes, and (c) exploit GNE efficiently to improve the performance on downstream tasks? The knowledge of GNE is valuable for various tasks like node classification, and targeted advertising. However, identifying GNE such as homophily, heterophily or their combination is challenging in real-world graphs due to limited availability of node labels and noisy edges. We propose NetEffect, a graph mining approach to address the above issues, enjoying the following properties: (i) Principled: a statistical test to determine the presence of GNE in a graph with few node labels; (ii) General and Explainable: a closed-form solution to estimate the specific type of GNE observed; and (iii) Accurate and Scalable: the integration of GNE for accurate and fast node classification. Applied on real-world graphs, NetEffect discovers the unexpected absence of GNE in numerous graphs, which were recognized to exhibit heterophily. Further, we show that incorporating GNE is effective on node classification. On a million-scale real-world graph, NetEffect achieves over 7 times speedup (14 minutes vs. 2 hours) compared to most competitors.

Zhenwei Dai, Vasileios Ioannidis, Soji Adeshina et al.

What target labels are most effective for graph neural network (GNN) training? In some applications where GNNs excel-like drug design or fraud detection, labeling new instances is expensive. We develop a data-efficient active sampling framework, ScatterSample, to train GNNs under an active learning setting. ScatterSample employs a sampling module termed DiverseUncertainty to collect instances with large uncertainty from different regions of the sample space for labeling. To ensure diversification of the selected nodes, DiverseUncertainty clusters the high uncertainty nodes and selects the representative nodes from each cluster. Our ScatterSample algorithm is further supported by rigorous theoretical analysis demonstrating its advantage compared to standard active sampling methods that aim to simply maximize the uncertainty and not diversify the samples. In particular, we show that ScatterSample is able to efficiently reduce the model uncertainty over the whole sample space. Our experiments on five datasets show that ScatterSample significantly outperforms the other GNN active learning baselines, specifically it reduces the sampling cost by up to 50% while achieving the same test accuracy.

Bo He, Xiang Song, Vincent Gao et al.

Low-quality listings and bad actor behavior in online retail websites threatens e-commerce business as these result in sub-optimal buying experience and erode customer trust. When a new listing is created, how to tell it has good-quality? Is the method effective, fast, and scalable? Previous approaches often have three limitations/challenges: (1) unable to handle cold start problems where new sellers/listings lack sufficient selling histories. (2) inability of scoring hundreds of millions of listings at scale, or compromise performance for scalability. (3) has space challenges from large-scale graph with giant e-commerce business size. To overcome these limitations/challenges, we proposed ColdGuess, an inductive graph-based risk predictor built upon a heterogeneous seller product graph, which effectively identifies risky seller/product/listings at scale. ColdGuess tackles the large-scale graph by consolidated nodes, and addresses the cold start problems using homogeneous influence1. The evaluation on real data demonstrates that ColdGuess has stable performance as the number of unknown features increases. It outperforms the lightgbm2 by up to 34 pcp ROC-AUC in a cold start case when a new seller sells a new product . The resulting system, ColdGuess, is effective, adaptable to changing risky seller behavior, and is already in production

Minjie Wang, Quan Gan, David Wipf et al.

Although RDBs store vast amounts of rich, informative data spread across interconnected tables, the progress of predictive machine learning models as applied to such tasks arguably falls well behind advances in other domains such as computer vision or natural language processing. This deficit stems, at least in part, from the lack of established/public RDB benchmarks as needed for training and evaluation purposes. As a result, related model development thus far often defaults to tabular approaches trained on ubiquitous single-table benchmarks, or on the relational side, graph-based alternatives such as GNNs applied to a completely different set of graph datasets devoid of tabular characteristics. To more precisely target RDBs lying at the nexus of these two complementary regimes, we explore a broad class of baseline models predicated on: (i) converting multi-table datasets into graphs using various strategies equipped with efficient subsampling, while preserving tabular characteristics; and (ii) trainable models with well-matched inductive biases that output predictions based on these input subgraphs. Then, to address the dearth of suitable public benchmarks and reduce siloed comparisons, we assemble a diverse collection of (i) large-scale RDB datasets and (ii) coincident predictive tasks. From a delivery standpoint, we operationalize the above four dimensions (4D) of exploration within a unified, scalable open-source toolbox called 4DBInfer. We conclude by presenting evaluations using 4DBInfer, the results of which highlight the importance of considering each such dimension in the design of RDB predictive models, as well as the limitations of more naive approaches such as simply joining adjacent tables. Our source code is released at https://github.com/awslabs/multi-table-benchmark .

Namyong Park, Ryan Rossi, Xing Wang et al.

The choice of a graph learning (GL) model (i.e., a GL algorithm and its hyperparameter settings) has a significant impact on the performance of downstream tasks. However, selecting the right GL model becomes increasingly difficult and time consuming as more and more GL models are developed. Accordingly, it is of great significance and practical value to equip users of GL with the ability to perform a near-instantaneous selection of an effective GL model without manual intervention. Despite the recent attempts to tackle this important problem, there has been no comprehensive benchmark environment to evaluate the performance of GL model selection methods. To bridge this gap, we present GLEMOS in this work, a comprehensive benchmark for instantaneous GL model selection that makes the following contributions. (i) GLEMOS provides extensive benchmark data for fundamental GL tasks, i.e., link prediction and node classification, including the performances of 366 models on 457 graphs on these tasks. (ii) GLEMOS designs multiple evaluation settings, and assesses how effectively representative model selection techniques perform in these different settings. (iii) GLEMOS is designed to be easily extended with new models, new graphs, and new performance records. (iv) Based on the experimental results, we discuss the limitations of existing approaches and highlight future research directions. To promote research on this significant problem, we make the benchmark data and code publicly available at https://github.com/facebookresearch/glemos.

Karish Grover, Geoffrey J. Gordon, Christos Faloutsos

Does the intrinsic curvature of complex networks hold the key to unveiling graph anomalies that conventional approaches overlook? Reconstruction-based graph anomaly detection (GAD) methods overlook such geometric outliers, focusing only on structural and attribute-level anomalies. To this end, we propose CurvGAD - a mixed-curvature graph autoencoder that introduces the notion of curvature-based geometric anomalies. CurvGAD introduces two parallel pipelines for enhanced anomaly interpretability: (1) Curvature-equivariant geometry reconstruction, which focuses exclusively on reconstructing the edge curvatures using a mixed-curvature, Riemannian encoder and Gaussian kernel-based decoder; and (2) Curvature-invariant structure and attribute reconstruction, which decouples structural and attribute anomalies from geometric irregularities by regularizing graph curvature under discrete Ollivier-Ricci flow, thereby isolating the non-geometric anomalies. By leveraging curvature, CurvGAD refines the existing anomaly classifications and identifies new curvature-driven anomalies. Extensive experimentation over 10 real-world datasets (both homophilic and heterophilic) demonstrates an improvement of up to 6.5% over state-of-the-art GAD methods. The code is available at: https://github.com/karish-grover/curvgad.

Karish Grover, Haiyang Yu, Xiang Song et al.

Can integrating spectral and curvature signals unlock new potential in graph representation learning? Non-Euclidean geometries, particularly Riemannian manifolds such as hyperbolic (negative curvature) and spherical (positive curvature), offer powerful inductive biases for embedding complex graph structures like scale-free, hierarchical, and cyclic patterns. Meanwhile, spectral filtering excels at processing signal variations across graphs, making it effective in homophilic and heterophilic settings. Leveraging both can significantly enhance the learned representations. To this end, we propose Spectro-Riemannian Graph Neural Networks (CUSP) - the first graph representation learning paradigm that unifies both CUrvature (geometric) and SPectral insights. CUSP is a mixed-curvature spectral GNN that learns spectral filters to optimize node embeddings in products of constant-curvature manifolds (hyperbolic, spherical, and Euclidean). Specifically, CUSP introduces three novel components: (a) Cusp Laplacian, an extension of the traditional graph Laplacian based on Ollivier-Ricci curvature, designed to capture the curvature signals better; (b) Cusp Filtering, which employs multiple Riemannian graph filters to obtain cues from various bands in the eigenspectrum; and (c) Cusp Pooling, a hierarchical attention mechanism combined with a curvature-based positional encoding to assess the relative importance of differently curved substructures in our graph. Empirical evaluation across eight homophilic and heterophilic datasets demonstrates the superiority of CUSP in node classification and link prediction tasks, with a gain of up to 5.3% over state-of-the-art models. The code is available at: https://github.com/amazon-science/cusp.

Da Zheng, Xiang Song, Qi Zhu et al.

Graph machine learning (GML) is effective in many business applications. However, making GML easy to use and applicable to industry applications with massive datasets remain challenging. We developed GraphStorm, which provides an end-to-end solution for scalable graph construction, graph model training and inference. GraphStorm has the following desirable properties: (a) Easy to use: it can perform graph construction and model training and inference with just a single command; (b) Expert-friendly: GraphStorm contains many advanced GML modeling techniques to handle complex graph data and improve model performance; (c) Scalable: every component in GraphStorm can operate on graphs with billions of nodes and can scale model training and inference to different hardware without changing any code. GraphStorm has been used and deployed for over a dozen billion-scale industry applications after its release in May 2023. It is open-sourced in Github: https://github.com/awslabs/graphstorm.

Karish Grover, Hanqing Zeng, Yinglong Xia et al.

Does text have an intrinsic curvature? Language is increasingly modeled in curved geometries - hyperbolic spaces for hierarchy, mixed-curvature manifolds for compositional structure - yet a basic scientific question remains unresolved: what does curvature mean for text itself, in a way that is native to language rather than an artifact of the embedding space we choose? We argue that text does indeed have curvature, and show how to detect it, define it, and use it. To this end, we propose Texture, a text-native, word-level discrete curvature signal, and make three contributions. (a) Existence: We provide empirical and theoretical certificates that semantic inference in natural corpora is non-flat, i.e. language has inherent curvature. (b) Definition: We define Texture by reconciling left- and right-context beliefs around a masked word through a Schrodinger bridge, yielding a curvature field that is positive where context focuses meaning and negative where it fans out into competing continuations. (c) Utility: Texture is actionable: it serves as a general-purpose measurement and control primitive enabling geometry without geometric training; we instantiate it on two representative tasks, improving long-context inference through curvature-guided compression and retrieval-augmented generation through curvature-guided routing. Together, our results establish a text-native curvature paradigm, making curvature measurable and practically useful.

Kezhi Kong, Jiani Zhang, Zhengyuan Shen et al.

Large Language Models (LLMs) trained on large volumes of data excel at various natural language tasks, but they cannot handle tasks requiring knowledge that has not been trained on previously. One solution is to use a retriever that fetches relevant information to expand LLM's knowledge scope. However, existing textual-oriented retrieval-based LLMs are not ideal on structured table data due to diversified data modalities and large table sizes. In this work, we propose OpenTab, an open-domain table reasoning framework powered by LLMs. Overall, OpenTab leverages table retriever to fetch relevant tables and then generates SQL programs to parse the retrieved tables efficiently. Utilizing the intermediate data derived from the SQL executions, it conducts grounded inference to produce accurate response. Extensive experimental evaluation shows that OpenTab significantly outperforms baselines in both open- and closed-domain settings, achieving up to 21.5% higher accuracy. We further run ablation studies to validate the efficacy of our proposed designs of the system.

Jielin Qiu, Andrea Madotto, Zhaojiang Lin et al. · cmu, microsoft-research

Vision-extended LLMs have made significant strides in Visual Question Answering (VQA). Despite these advancements, VLLMs still encounter substantial difficulties in handling queries involving long-tail entities, with a tendency to produce erroneous or hallucinated responses. In this work, we introduce a novel evaluative benchmark named \textbf{SnapNTell}, specifically tailored for entity-centric VQA. This task aims to test the models' capabilities in identifying entities and providing detailed, entity-specific knowledge. We have developed the \textbf{SnapNTell Dataset}, distinct from traditional VQA datasets: (1) It encompasses a wide range of categorized entities, each represented by images and explicitly named in the answers; (2) It features QA pairs that require extensive knowledge for accurate responses. The dataset is organized into 22 major categories, containing 7,568 unique entities in total. For each entity, we curated 10 illustrative images and crafted 10 knowledge-intensive QA pairs. To address this novel task, we devised a scalable, efficient, and transparent retrieval-augmented multimodal LLM. Our approach markedly outperforms existing methods on the SnapNTell dataset, achieving a 66.5\% improvement in the BELURT score. We will soon make the dataset and the source code publicly accessible.

Meng-Chieh Lee, Qi Zhu, Costas Mavromatis et al.

Given a semi-structured knowledge base (SKB), where text documents are interconnected by relations, how can we effectively retrieve relevant information to answer user questions? Retrieval-Augmented Generation (RAG) retrieves documents to assist large language models (LLMs) in question answering; while Graph RAG (GRAG) uses structured knowledge bases as its knowledge source. However, many questions require both textual and relational information from SKB - referred to as "hybrid" questions - which complicates the retrieval process and underscores the need for a hybrid retrieval method that leverages both information. In this paper, through our empirical analysis, we identify key insights that show why existing methods may struggle with hybrid question answering (HQA) over SKB. Based on these insights, we propose HybGRAG for HQA consisting of a retriever bank and a critic module, with the following advantages: (1) Agentic, it automatically refines the output by incorporating feedback from the critic module, (2) Adaptive, it solves hybrid questions requiring both textual and relational information with the retriever bank, (3) Interpretable, it justifies decision making with intuitive refinement path, and (4) Effective, it surpasses all baselines on HQA benchmarks. In experiments on the STaRK benchmark, HybGRAG achieves significant performance gains, with an average relative improvement in Hit@1 of 51%.

Rohan Kumar, Youngmin Kim, Sunitha Ravi et al.

Pretrained Large Language Models (LLMs) have gained significant attention for addressing open-domain Question Answering (QA). While they exhibit high accuracy in answering questions related to common knowledge, LLMs encounter difficulties in learning about uncommon long-tail knowledge (tail entities). Since manually constructing QA datasets demands substantial human resources, the types of existing QA datasets are limited, leaving us with a scarcity of datasets to study the performance of LLMs on tail entities. In this paper, we propose an automatic approach to generate specialized QA datasets for tail entities and present the associated research challenges. We conduct extensive experiments by employing pretrained LLMs on our newly generated long-tail QA datasets, comparing their performance with and without external resources including Wikipedia and Wikidata knowledge graphs.

Luca Masserano, Abdul Fatir Ansari, Boran Han et al.

How to best develop foundational models for time series forecasting remains an important open question. Tokenization is a crucial consideration in this effort: what is an effective discrete vocabulary for a real-valued sequential input? To address this question, we develop WaveToken, a wavelet-based tokenizer that allows models to learn complex representations directly in the space of time-localized frequencies. Our method first scales and decomposes the input time series, then thresholds and quantizes the wavelet coefficients, and finally pre-trains an autoregressive model to forecast coefficients for the forecast horizon. By decomposing coarse and fine structures in the inputs, wavelets provide an eloquent and compact language for time series forecasting that simplifies learning. Empirical results on a comprehensive benchmark, including 42 datasets for both in-domain and zero-shot settings, show that WaveToken: i) provides better accuracy than recently proposed foundation models for forecasting while using a much smaller vocabulary (1024 tokens), and performs on par or better than modern deep learning models trained specifically on each dataset; and ii) exhibits superior generalization capabilities, achieving the best average rank across all datasets for three complementary metrics. In addition, we show that our method can easily capture complex temporal patterns of practical relevance that are challenging for other recent pre-trained models, including trends, sparse spikes, and non-stationary time series with varying frequencies evolving over time.

Xiyuan Zhang, Danielle C. Maddix, Junming Yin et al. · amazon-science

Since the seminal work of TabPFN, research on tabular foundation models (TFMs) based on in-context learning (ICL) has challenged long-standing paradigms in machine learning. Without seeing any real-world data, models pretrained on purely synthetic datasets generalize remarkably well across diverse datasets, often using only a moderate number of in-context examples. This shifts the focus in tabular machine learning from model architecture design to the design of synthetic datasets, or, more precisely, to the prior distributions that generate them. Yet the guiding principles for prior design remain poorly understood. This work marks the first attempt to address the gap. We systematically investigate and identify key properties of synthetic priors that allow pretrained TFMs to generalize well. Based on these insights, we introduce Mitra, a TFM trained on a curated mixture of synthetic priors selected for their diversity, distinctiveness, and performance on real-world tabular data. Mitra consistently outperforms state-of-the-art TFMs, such as TabPFNv2 and TabICL, across both classification and regression benchmarks, with better sample efficiency.

Mst. Shamima Hossain, Christos Faloutsos, Boris Baer et al.

Honeybees are vital for pollination and food production. Among many factors, extreme temperature (e.g., due to climate change) is particularly dangerous for bee health. Anticipating such extremities would allow beekeepers to take early preventive action. Thus, given sensor (temperature) time series data from beehives, how can we find patterns and do forecasting? Forecasting is crucial as it helps spot unexpected behavior and thus issue warnings to the beekeepers. In that case, what are the right models for forecasting? ARIMA, RNNs, or something else? We propose the EBV (Electronic Bee-Veterinarian) method, which has the following desirable properties: (i) principled: it is based on a) diffusion equations from physics and b) control theory for feedback-loop controllers; (ii) effective: it works well on multiple, real-world time sequences, (iii) explainable: it needs only a handful of parameters (e.g., bee strength) that beekeepers can easily understand and trust, and (iv) scalable: it performs linearly in time. We applied our method to multiple real-world time sequences, and found that it yields accurate forecasting (up to 49% improvement in RMSE compared to baselines), and segmentation. Specifically, discontinuities detected by EBV mostly coincide with domain expert's opinions, showcasing our approach's potential and practical feasibility. Moreover, EBV is scalable and fast, taking about 20 minutes on a stock laptop for reconstructing two months of sensor data.

Meng-Chieh Lee, Haiyang Yu, Jian Zhang et al.

Given a node-attributed graph, and a graph task (link prediction or node classification), can we tell if a graph neural network (GNN) will perform well? More specifically, do the graph structure and the node features carry enough usable information for the task? Our goals are (1) to develop a fast tool to measure how much information is in the graph structure and in the node features, and (2) to exploit the information to solve the task, if there is enough. We propose NetInfoF, a framework including NetInfoF_Probe and NetInfoF_Act, for the measurement and the exploitation of network usable information (NUI), respectively. Given a graph data, NetInfoF_Probe measures NUI without any model training, and NetInfoF_Act solves link prediction and node classification, while two modules share the same backbone. In summary, NetInfoF has following notable advantages: (a) General, handling both link prediction and node classification; (b) Principled, with theoretical guarantee and closed-form solution; (c) Effective, thanks to the proposed adjustment to node similarity; (d) Scalable, scaling linearly with the input size. In our carefully designed synthetic datasets, NetInfoF correctly identifies the ground truth of NUI and is the only method being robust to all graph scenarios. Applied on real-world datasets, NetInfoF wins in 11 out of 12 times on link prediction compared to general GNN baselines.

Braulio V. Sánchez Vinces, Robson L. F. Cordeiro, Christos Faloutsos

How could we have an outlier detector that works even with nondimensional data, and ranks together both singleton microclusters ('one-off' outliers) and nonsingleton microclusters by their anomaly scores? How to obtain scores that are principled in one scalable and 'hands-off' manner? Microclusters of outliers indicate coalition or repetition in fraud activities, etc.; their identification is thus highly desirable. This paper presents McCatch: a new algorithm that detects microclusters by leveraging our proposed 'Oracle' plot (1NN Distance versus Group 1NN Distance). We study 31 real and synthetic datasets with up to 1M data elements to show that McCatch is the only method that answers both of the questions above; and, it outperforms 11 other methods, especially when the data has nonsingleton microclusters or is nondimensional. We also showcase McCatch's ability to detect meaningful microclusters in graphs, fingerprints, logs of network connections, text data, and satellite imagery. For example, it found a 30-elements microcluster of confirmed 'Denial of Service' attacks in the network logs, taking only ~3 minutes for 222K data elements on a stock desktop.

Matthew Butler, Yi Fan, Christos Faloutsos

The proposed method (FraudFox) provides solutions to adversarial attacks in a resource constrained environment. We focus on questions like the following: How suspicious is `Smith', trying to buy \$500 shoes, on Monday 3am? How to merge the risk scores, from a handful of risk-assessment modules (`oracles') in an adversarial environment? More importantly, given historical data (orders, prices, and what-happened afterwards), and business goals/restrictions, which transactions, like the `Smith' transaction above, which ones should we `pass', versus send to human investigators? The business restrictions could be: `at most $x$ investigations are feasible', or `at most \$$y$ lost due to fraud'. These are the two research problems we focus on, in this work. One approach to address the first problem (`oracle-weighting'), is by using Extended Kalman Filters with dynamic importance weights, to automatically and continuously update our weights for each 'oracle'. For the second problem, we show how to derive an optimal decision surface, and how to compute the Pareto optimal set, to allow what-if questions. An important consideration is adaptation: Fraudsters will change their behavior, according to our past decisions; thus, we need to adapt accordingly. The resulting system, \method, is scalable, adaptable to changing fraudster behavior, effective, and already in \textbf{production} at Amazon. FraudFox augments a fraud prevention sub-system and has led to significant performance gains.

Karish Grover, Theodore Vasiloudis, Han Xie et al.

Can multi-task self-supervised learning on graphs be coordinated without the usual tug-of-war between objectives? Graph self-supervised learning (SSL) offers a growing toolbox of pretext objectives: mutual information, reconstruction, contrastive learning; yet combining them reliably remains a challenge due to objective interference and training instability. Most multi-pretext pipelines use per-update mixing, forcing every parameter update to be a compromise, leading to three failure modes: Disagreement (conflict-induced negative transfer), Drift (nonstationary objective utility), and Drought (hidden starvation of underserved objectives). We argue that coordination is fundamentally a temporal allocation problem: deciding when each objective receives optimization budget, not merely how to weigh them. We introduce ControlG, a control-theoretic framework that recasts multi-objective graph SSL as feedback-controlled temporal allocation by estimating per-objective difficulty and pairwise antagonism, planning target budgets via a Pareto-aware log-hypervolume planner, and scheduling with a Proportional-Integral-Derivative (PID) controller. Across 9 datasets, ControlG consistently outperforms state-of-the-art baselines, while producing an auditable schedule that reveals which objectives drove learning.

Annan Yu, Danielle C. Maddix, Boran Han et al.

Time series foundation models (TSFMs) are a class of potentially powerful, general-purpose tools for time series forecasting and related temporal tasks, but their behavior is strongly shaped by subtle inductive biases in their design. Rather than developing a new model and claiming that it is better than existing TSFMs, e.g., by winning on existing well-established benchmarks, our objective is to understand how the various ``knobs'' of the training process affect model quality. Using a mix of theory and controlled empirical evaluation, we identify several design choices (patch size, embedding choice, training objective, etc.) and show how they lead to implicit biases in fundamental model properties (temporal behavior, geometric structure, how aggressively or not the model regresses to the mean, etc.); and we show how these biases can be intuitive or very counterintuitive, depending on properties of the model and data. We also illustrate in a case study on outlier handling how multiple biases can interact in complex ways; and we discuss implications of our results for learning the bitter lesson and building TSFMs.

Annan Yu, Danielle C. Maddix, Boran Han et al.

Transformers are widely used across data modalities, and yet the principles distilled from text models often transfer imperfectly to models trained to other modalities. In this paper, we analyze Transformers through the lens of rank structure. Our focus is on the time series setting, where the structural properties of the data differ remarkably from those of text or vision. We show that time-series embeddings, unlike text or vision, exhibit sharply decaying singular value spectra: small patch sizes and smooth continuous mappings concentrate the data into low-rank subspaces. From this, we prove that the associated $Q/K/V$ projections admit accurate low-rank approximations, and that attention layers become compressible in proportion to the decay of the embedding spectrum. We introduce the concept of flow-of-ranks, a phenomenon by which nonlinear mixing across depth inflates the rank, explaining why early layers are most amenable to compression and why ranks grow with depth. Guided by these theoretical and empirical results, we use these insights to compress Chronos, a large time series foundation model, achieving a reduction of $65\%$ in inference time and $81\%$ in memory, without loss of accuracy. Our findings provide principled guidance for allocating width, depth, and heads in time series foundation models, and for exploiting their inherent compressibility.

Robson L. F. Cordeiro, Meng-Chieh Lee, Christos Faloutsos

Given a set of financial transactions (who buys from whom, when, and for how much), as well as prior information from buyers and sellers, how can we find fraudulent transactions? If we have labels for some transactions for known types of fraud, we can build a classifier. However, we also want to find new types of fraud, still unknown to the domain experts ('Detection'). Moreover, we also want to provide evidence to experts that supports our opinion ('Justification'). In this paper, we propose FRAUDGUESS, to achieve two goals: (a) for 'Detection', it spots new types of fraud as micro-clusters in a carefully designed feature space; (b) for 'Justification', it uses visualization and heatmaps for evidence, as well as an interactive dashboard for deep dives. FRAUDGUESS is used in real life and is currently considered for deployment in an Anonymous Financial Institution (AFI). Thus, we also present the three new behaviors that FRAUDGUESS discovered in a real, million-scale financial dataset. Two of these behaviors are deemed fraudulent or suspicious by domain experts, catching hundreds of fraudulent transactions that would otherwise go un-noticed.

Jiaming Liang, Chuan Lei, Xiao Qin et al.

Data-centric AI focuses on understanding and utilizing high-quality, relevant data in training machine learning (ML) models, thereby increasing the likelihood of producing accurate and useful results. Automatic feature augmentation, aiming to augment the initial base table with useful features from other tables, is critical in data preparation as it improves model performance, robustness, and generalizability. While recent works have investigated automatic feature augmentation, most of them have limited capabilities in utilizing all useful features as many of them are in candidate tables not directly joinable with the base table. Worse yet, with numerous join paths leading to these distant features, existing solutions fail to fully exploit them within a reasonable compute budget. We present FeatNavigator, an effective and efficient framework that explores and integrates high-quality features in relational tables for ML models. FeatNavigator evaluates a feature from two aspects: (1) the intrinsic value of a feature towards an ML task (i.e., feature importance) and (2) the efficacy of a join path connecting the feature to the base table (i.e., integration quality). FeatNavigator strategically selects a small set of available features and their corresponding join paths to train a feature importance estimation model and an integration quality prediction model. Furthermore, FeatNavigator's search algorithm exploits both estimated feature importance and integration quality to identify the optimized feature augmentation plan. Our experimental results show that FeatNavigator outperforms state-of-the-art solutions on five public datasets by up to 40.1% in ML model performance.

Shichang Zhang, Da Zheng, Jiani Zhang et al.

Text-rich graphs, prevalent in data mining contexts like e-commerce and academic graphs, consist of nodes with textual features linked by various relations. Traditional graph machine learning models, such as Graph Neural Networks (GNNs), excel in encoding the graph structural information, but have limited capability in handling rich text on graph nodes. Large Language Models (LLMs), noted for their superior text understanding abilities, offer a solution for processing the text in graphs but face integration challenges due to their limitation for encoding graph structures and their computational complexities when dealing with extensive text in large neighborhoods of interconnected nodes. This paper introduces ``Hierarchical Compression'' (HiCom), a novel method to align the capabilities of LLMs with the structure of text-rich graphs. HiCom processes text in a node's neighborhood in a structured manner by organizing the extensive textual information into a more manageable hierarchy and compressing node text step by step. Therefore, HiCom not only preserves the contextual richness of the text but also addresses the computational challenges of LLMs, which presents an advancement in integrating the text processing power of LLMs with the structural complexities of text-rich graphs. Empirical results show that HiCom can outperform both GNNs and LLM backbones for node classification on e-commerce and citation graphs. HiCom is especially effective for nodes from a dense region in a graph, where it achieves a 3.48% average performance improvement on five datasets while being more efficient than LLM backbones.

Jielin Qiu, William Han, Xuandong Zhao et al.

With the development of large models, watermarks are increasingly employed to assert copyright, verify authenticity, or monitor content distribution. As applications become more multimodal, the utility of watermarking techniques becomes even more critical. The effectiveness and reliability of these watermarks largely depend on their robustness to various disturbances. However, the robustness of these watermarks in real-world scenarios, particularly under perturbations and corruption, is not well understood. To highlight the significance of robustness in watermarking techniques, our study evaluated the robustness of watermarked content generated by image and text generation models against common real-world image corruptions and text perturbations. Our results could pave the way for the development of more robust watermarking techniques in the future. Our project website can be found at \url{https://mmwatermark-robustness.github.io/}.

Jielin Qiu, William Han, Winfred Wang et al.

Open-domain real-world entity recognition is essential yet challenging, involving identifying various entities in diverse environments. The lack of a suitable evaluation dataset has been a major obstacle in this field due to the vast number of entities and the extensive human effort required for data curation. We introduce Entity6K, a comprehensive dataset for real-world entity recognition, featuring 5,700 entities across 26 categories, each supported by 5 human-verified images with annotations. Entity6K offers a diverse range of entity names and categorizations, addressing a gap in existing datasets. We conducted benchmarks with existing models on tasks like image captioning, object detection, zero-shot classification, and dense captioning to demonstrate Entity6K's effectiveness in evaluating models' entity recognition capabilities. We believe Entity6K will be a valuable resource for advancing accurate entity recognition in open-domain settings.

Namyong Park, Fuchen Liu, Purvanshi Mehta et al.

How can we perform knowledge reasoning over temporal knowledge graphs (TKGs)? TKGs represent facts about entities and their relations, where each fact is associated with a timestamp. Reasoning over TKGs, i.e., inferring new facts from time-evolving KGs, is crucial for many applications to provide intelligent services. However, despite the prevalence of real-world data that can be represented as TKGs, most methods focus on reasoning over static knowledge graphs, or cannot predict future events. In this paper, we present a problem formulation that unifies the two major problems that need to be addressed for an effective reasoning over TKGs, namely, modeling the event time and the evolving network structure. Our proposed method EvoKG jointly models both tasks in an effective framework, which captures the ever-changing structural and temporal dynamics in TKGs via recurrent event modeling, and models the interactions between entities based on the temporal neighborhood aggregation framework. Further, EvoKG achieves an accurate modeling of event time, using flexible and efficient mechanisms based on neural density estimation. Experiments show that EvoKG outperforms existing methods in terms of effectiveness (up to 77% and 116% more accurate time and link prediction) and efficiency.

Shubhranshu Shekhar, Dhivya Eswaran, Bryan Hooi et al.

Given a cardiac-arrest patient being monitored in the ICU (intensive care unit) for brain activity, how can we predict their health outcomes as early as possible? Early decision-making is critical in many applications, e.g. monitoring patients may assist in early intervention and improved care. On the other hand, early prediction on EEG data poses several challenges: (i) earliness-accuracy trade-off; observing more data often increases accuracy but sacrifices earliness, (ii) large-scale (for training) and streaming (online decision-making) data processing, and (iii) multi-variate (due to multiple electrodes) and multi-length (due to varying length of stay of patients) time series. Motivated by this real-world application, we present BeneFitter that infuses the incurred savings from an early prediction as well as the cost from misclassification into a unified domain-specific target called benefit. Unifying these two quantities allows us to directly estimate a single target (i.e. benefit), and importantly, dictates exactly when to output a prediction: when benefit estimate becomes positive. BeneFitter (a) is efficient and fast, with training time linear in the number of input sequences, and can operate in real-time for decision-making, (b) can handle multi-variate and variable-length time-series, suitable for patient data, and (c) is effective, providing up to 2x time-savings with equal or better accuracy as compared to competitors.

Meng-Chieh Lee, Shubhranshu Shekhar, Christos Faloutsos et al.

In a cloud of m-dimensional data points, how would we spot, as well as rank, both single-point- as well as group- anomalies? We are the first to generalize anomaly detection in two dimensions: The first dimension is that we handle both point-anomalies, as well as group-anomalies, under a unified view -- we shall refer to them as generalized anomalies. The second dimension is that gen2Out not only detects, but also ranks, anomalies in suspiciousness order. Detection, and ranking, of anomalies has numerous applications: For example, in EEG recordings of an epileptic patient, an anomaly may indicate a seizure; in computer network traffic data, it may signify a power failure, or a DoS/DDoS attack. We start by setting some reasonable axioms; surprisingly, none of the earlier methods pass all the axioms. Our main contribution is the gen2Out algorithm, that has the following desirable properties: (a) Principled and Sound anomaly scoring that obeys the axioms for detectors, (b) Doubly-general in that it detects, as well as ranks generalized anomaly -- both point- and group-anomalies, (c) Scalable, it is fast and scalable, linear on input size. (d) Effective, experiments on real-world epileptic recordings (200GB) demonstrate effectiveness of gen2Out as confirmed by clinicians. Experiments on 27 real-world benchmark datasets show that gen2Out detects ground truth groups, matches or outperforms point-anomaly baseline algorithms on accuracy, with no competition for group-anomalies and requires about 2 minutes for 1 million data points on a stock machine.

Shimiao Li, Amritanshu Pandey, Bryan Hooi et al.

Given sensor readings over time from a power grid, how can we accurately detect when an anomaly occurs? A key part of achieving this goal is to use the network of power grid sensors to quickly detect, in real-time, when any unusual events, whether natural faults or malicious, occur on the power grid. Existing bad-data detectors in the industry lack the sophistication to robustly detect broad types of anomalies, especially those due to emerging cyber-attacks, since they operate on a single measurement snapshot of the grid at a time. New ML methods are more widely applicable, but generally do not consider the impact of topology change on sensor measurements and thus cannot accommodate regular topology adjustments in historical data. Hence, we propose DYNWATCH, a domain knowledge based and topology-aware algorithm for anomaly detection using sensors placed on a dynamic grid. Our approach is accurate, outperforming existing approaches by 20% or more (F-measure) in experiments; and fast, running in less than 1.7ms on average per time tick per sensor on a 60K+ branch case using a laptop computer, and scaling linearly in the size of the graph.

Minji Yoon, Théophile Gervet, Bryan Hooi et al.

Graph data is ubiquitous in academia and industry, from social networks to bioinformatics. The pervasiveness of graphs today has raised the demand for algorithms that can answer various questions: Which products would a user like to purchase given her order list? Which users are buying fake followers to increase their public reputation? Myriads of new graph mining algorithms are proposed every year to answer such questions - each with a distinct problem formulation, computational time, and memory footprint. This lack of unity makes it difficult for a practitioner to compare different algorithms and pick the most suitable one for a specific application. These challenges - even more severe for non-experts - create a gap in which state-of-the-art techniques developed in academic settings fail to be optimally deployed in real-world applications. To bridge this gap, we propose AUTOGM, an automated system for graph mining algorithm development. We first define a unified framework UNIFIEDGM that integrates various message-passing based graph algorithms, ranging from conventional algorithms like PageRank to graph neural networks. Then UNIFIEDGM defines a search space in which five parameters are required to determine a graph algorithm. Under this search space, AUTOGM explicitly optimizes for the optimal parameter set of UNIFIEDGM using Bayesian Optimization. AUTOGM defines a novel budget-aware objective function for the optimization to incorporate a practical issue - finding the best speed-accuracy trade-off under a computation budget - into the graph algorithm generation problem. Experiments on real-world benchmark datasets demonstrate that AUTOGM generates novel graph mining algorithms with the best speed/accuracy trade-off compared to existing models with heuristic parameters.

Minji Yoon, Bryan Hooi, Kijung Shin et al.

Given a dynamic graph stream, how can we detect the sudden appearance of anomalous patterns, such as link spam, follower boosting, or denial of service attacks? Additionally, can we categorize the types of anomalies that occur in practice, and theoretically analyze the anomalous signs arising from each type? In this work, we propose AnomRank, an online algorithm for anomaly detection in dynamic graphs. AnomRank uses a two-pronged approach defining two novel metrics for anomalousness. Each metric tracks the derivatives of its own version of a 'node score' (or node importance) function. This allows us to detect sudden changes in the importance of any node. We show theoretically and experimentally that the two-pronged approach successfully detects two common types of anomalies: sudden weight changes along an edge, and sudden structural changes to the graph. AnomRank is (a) Fast and Accurate: up to 49.5x faster or 35% more accurate than state-of-the-art methods, (b) Scalable: linear in the number of edges in the input graph, processing millions of edges within 2 seconds on a stock laptop/desktop, and (c) Theoretically Sound: providing theoretical guarantees of the two-pronged approach.

Rui Wang, Danielle Maddix, Christos Faloutsos et al.

How can we learn a dynamical system to make forecasts, when some variables are unobserved? For instance, in COVID-19, we want to forecast the number of infected and death cases but we do not know the count of susceptible and exposed people. While mechanics compartment models are widely used in epidemic modeling, data-driven models are emerging for disease forecasting. We first formalize the learning of physics-based models as AutoODE, which leverages automatic differentiation to estimate the model parameters. Through a benchmark study on COVID-19 forecasting, we notice that physics-based mechanistic models significantly outperform deep learning. Our method obtains a 57.4% reduction in mean absolute errors for 7-day ahead COVID-19 forecasting compared with the best deep learning competitor. Such performance differences highlight the generalization problem in dynamical system learning due to distribution shift. We identify two scenarios where distribution shift can occur: changes in data domain and changes in parameter domain (system dynamics). Through systematic experiments on several dynamical systems, we found that deep learning models fail to forecast well under both scenarios. While much research on distribution shift has focused on changes in the data domain, our work calls attention to rethink generalization for learning dynamical systems.

Namyong Park, Andrey Kan, Christos Faloutsos et al.

Online recommendation is an essential functionality across a variety of services, including e-commerce and video streaming, where items to buy, watch, or read are suggested to users. Justifying recommendations, i.e., explaining why a user might like the recommended item, has been shown to improve user satisfaction and persuasiveness of the recommendation. In this paper, we develop a method for generating post-hoc justifications that can be applied to the output of any recommendation algorithm. Existing post-hoc methods are often limited in providing diverse justifications, as they either use only one of many available types of input data, or rely on the predefined templates. We address these limitations of earlier approaches by developing J-Recs, a method for producing concise and diverse justifications. J-Recs is a recommendation model-agnostic method that generates diverse justifications based on various types of product and user data (e.g., purchase history and product attributes). The challenge of jointly processing multiple types of data is addressed by designing a principled graph-based approach for justification generation. In addition to theoretical analysis, we present an extensive evaluation on synthetic and real-world data. Our results show that J-Recs satisfies desirable properties of justifications, and efficiently produces effective justifications, matching user preferences up to 20% more accurately than baselines.

Siddharth Bhatia, Rui Liu, Bryan Hooi et al.

Given a stream of graph edges from a dynamic graph, how can we assign anomaly scores to edges in an online manner, for the purpose of detecting unusual behavior, using constant time and memory? Existing approaches aim to detect individually surprising edges. In this work, we propose MIDAS, which focuses on detecting microcluster anomalies, or suddenly arriving groups of suspiciously similar edges, such as lockstep behavior, including denial of service attacks in network traffic data. We further propose MIDAS-F, to solve the problem by which anomalies are incorporated into the algorithm's internal states, creating a `poisoning' effect that can allow future anomalies to slip through undetected. MIDAS-F introduces two modifications: 1) We modify the anomaly scoring function, aiming to reduce the `poisoning' effect of newly arriving edges; 2) We introduce a conditional merge step, which updates the algorithm's data structures after each time tick, but only if the anomaly score is below a threshold value, also to reduce the `poisoning' effect. Experiments show that MIDAS-F has significantly higher accuracy than MIDAS. MIDAS has the following properties: (a) it detects microcluster anomalies while providing theoretical guarantees about its false positive probability; (b) it is online, thus processing each edge in constant time and constant memory, and also processes the data orders-of-magnitude faster than state-of-the-art approaches; (c) it provides up to 62% higher ROC-AUC than state-of-the-art approaches.