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Kijung Shin

Publications and source records attributed to Kijung Shin.

At least 19 recordsLinked to original sources

Do Higher-Order Models Win for Higher-Order Reasons? Rethinking Performance Gains in Hypergraph Learning

Higher-order models (e.g., hypergraph neural networks) often outperform lower-order baselines on hypergraph learning benchmarks, and their advantages are commonly attributed to their ability to exploit higher-order information. However, better performance alone does not establish this explanation. We therefore ask: Do higher-order models win for higher-order reasons? To investigate this question, we introduce a controlled performance-attribution framework that perturbs higher-order information while preserving the lower-order, i.e., pairwise, information. Across 25 commonly used hypergraph learning benchmarks spanning three tasks, we frequently observe an intriguing pattern: higher-order models originally outperform lower-order baselines, yet retain most of their advantage after perturbation. This suggests that much of the observed advantage remains achievable without the higher-order information. We then investigate potential lower-order explanations for these remaining gaps. We find that simple additions to a lower-order baseline, e.g., richer pairwise weighting, more steps of pairwise feature propagation, and normalization, reduce the remaining performance gaps, supporting lower-order explanations for part of the observed advantage. Our analysis calls for the hypergraph learning community to rethink performance attribution by distinguishing performance gains from their explanations, adopt stronger lower-order baselines, and use suitable benchmarks that better test the value of higher-order information.

cs.LG↗

Zero-Shot Tabular Learning via Hypergraph Reasoning with LLMs

Tabular data are prevalent across diverse domains such as healthcare and finance. Zero-shot tabular learning aims to make predictions without labeled data. However, existing LLM-based approaches rely on row-wise prompting, resulting in high inference cost and limited use of inter-row dependencies. In this work, we propose TABHGR+, an efficient relation-aware zero-shot framework for tabular data that leverages LLM-generated rules to label and group rows. Specifically, based on column and task descriptions, we use LLMs to generate rules that assign weak labels to all rows. To refine these noisy weak labels, we construct a hypergraph by grouping semantically related rows using LLM-generated rules and perform hypergraph-based label propagation. Lastly, we further enhance the LLM-generated hypergraph for propagation, which is potentially sub-optimal, by assigning label-adaptive weights to hyperedges. By requiring only a constant number of LLM calls independent of dataset size, TABHGR+ substantially reduces inference cost while achieving higher classification accuracy than zero-shot and strong few-shot baselines.

cs.LG↗

Message Passing Does More with Less for In-Context Learning on Graphs

Achieving strong performance with graph neural networks (GNNs) typically requires training and hyperparameter tuning for each dataset, incurring repeated costs and effort. Graph in-context learning (ICL) avoids this by using a single pretrained model to predict unknown node labels directly from labeled context nodes. Existing approaches, however, rely on dense attention across nodes, making inference increasingly expensive as graphs grow. In this work, we present Ephris, a new graph in-context learner built on sparse message passing, scaling linearly with the number of node-feature entries and graph edges. Ephris is pretrained entirely on synthetic graphs generated from structural causal models with diverse graph structures and relational dynamics, exposing the model to varied dependencies among topology, features, and labels. We evaluate Ephris on 51 node-classification datasets against 15 extensively tuned GNNs and existing graph ICL methods under both high- and low-label train/validation/test splits. Across both settings, Ephris ranks first on all four aggregate measures: Elo, improvability, average rank, and accuracy. Its inference cost remains comparable to training a single GNN once, while being over 10 times faster than previous graph ICL models. Together, these results advance the performance-runtime Pareto frontier, demonstrating that strong graph ICL does not require dense attention. Code and model weights are available at https://github.com/nums-ai/ephris.

cs.LG↗

Emergence of psychopathological computations in large language models

Can large language models (LLMs) instantiate computations of psychopathology? In this work, we establish a computational-theoretical framework to provide an account of psychopathology applicable to LLMs. Based on the framework, we conduct experiments supporting two key claims: first, that network-theoretic computational structures of psychopathology exist in LLMs; and second, that executing these computational structures results in psychopathological functions. We further observe that as LLM size increases, the computational structure of psychopathology becomes denser and the functions more effective. Taken together, the results suggest that network-theoretic computations of psychopathology may have emerged in LLMs. We discuss alternative explanations, including pattern matching, persona modeling, and semantic coherence, and argue that they are either complementary to our interpretation or less consistent with the data.

q-bio.NC↗

Causal Behavioral Evaluation of AI Agents at Scale via Automated Behavioral Science

As AI agents are increasingly deployed in complex and new environments, knowing the conditions that influence their behavior becomes an indispensable step for their reliable and safe deployment. Yet causal behavioral evaluation of AI agents remains manual and labor-intensive. We introduce Abs2Sim and AEROBAT, a system of methods that support causal behavioral evaluation of AI agents via automated behavioral science. Given a user-specified target behavior, the methods automatically execute a full pipeline of behavioral science research---generating hypotheses about the behavior, designing and executing controlled experiments, making behavioral assessments, analyzing the results, and writing reports. For 12 target behaviors, the methods generated and tested 73 hypotheses: designing 1,160 controlled experiments and executing 22,954 simulation rounds in total. Moderate-to-strong statistical evidence emerged for 30 hypotheses, revealing potential modulators of AI behavior. In sum, our results demonstrate that automated behavioral science can extend the reach of behavioral evaluation of AI agents.

cs.AI↗

TaLK: Text-attributed Graph Dataset Distillation via Coupling Language Model with Graph-Aware Kernel

Text-attributed graphs (TAGs) are widely used in many real-world domains, and learning on TAGs requires jointly modeling text semantics and graph structure. A standard approach for modeling TAGs is to combine a language model (LM) and a graph neural network (GNN), but joint training is computationally expensive and difficult to scale. Dataset distillation is a promising way to reduce training costs, but existing methods are not well suited to TAGs because they are typically designed for a single modality or still require repeatedly training expensive LM-GNN models on the full dataset during distillation. To address this, we propose TaLK, an effective dataset distillation method for TAGs that couples an LM with a graph-aware neural tangent kernel. This design enables efficient dataset distillation, avoiding repeated joint training on the full dataset while reflecting both textual and structural information for effective TAG learning. Experiments on multiple TAG benchmarks show that TaLK consistently outperforms existing baselines and achieves up to 97% of full-dataset performance with only 1% synthetic data.

cs.LG↗

Training-Free LLM-Based Recommendation with Post-LLM Item Refinement Using Collaborative Signals

Large language models (LLMs) have shown promise for training-free recommendation, but LLM-generated user interests are often too broad for fine-grained item retrieval. Existing methods incorporate collaborative filtering (CF) signals in a pre-LLM manner through candidate reranking or prompt augmentation, yielding limited gains. We propose CoRRe, a training-free recommendation framework with a post-LLM paradigm that injects CF signals into LLM-generated item representations, which are later matched with LLM-generated user interests for ranking. Specifically, CoRRe refines the directions of item embeddings using an item-item co-purchase graph and their magnitudes using item popularity. Experiments on real-world datasets show that CoRRe consistently outperforms existing training-free methods and achieves competitive or superior performance compared with training-based methods, without requiring any model training or task-specific fine-tuning.

cs.IR↗

A Survey on Centrality and Importance Measures in Hypergraphs: Categorization and Empirical Insights

Identifying central entities and interactions is a fundamental problem in network science. While well-studied for graphs (pairwise relations), many biological and social systems exhibit higher-order interactions best modeled by hypergraphs. This has led to a proliferation of specialized hypergraph centrality measures, but the field remains fragmented and lacks a unifying framework. This paper addresses this gap by providing the first systematic survey of 39 distinct measures. We introduce a novel taxonomy classifying them as: (1) structural (topology-based), (2) functional (impact on system dynamics), or (3) contextual (incorporating external features). We also present an experimental assessment comparing their empirical similarity and computation time. Finally, we discuss applications, establishing a coherent roadmap for future research in this area.

physics.soc-ph↗

Improving Rare Medication Recommendation with Counterfactual Data Augmentation and Large Language Models

AI-based medication recommendation systems have attracted substantial attention due to their potential to enhance patient safety and therapeutic outcomes. Despite the clinical importance of accurately recommending rarely prescribed medications (rare-meds), we observe that most existing methods show significantly lower predictive performance for rare-meds. We attribute this issue to two intrinsic limitations: (a) the inherent scarcity of data for rare-meds and (b) limited consideration of co-recommended medications. To address these limitations, we propose GenRxR, a novel framework based on large language models (LLMs). GenRxR leverages the medical knowledge and clinical reasoning capability of LLMs to generate counterfactual medical data, mitigating the data scarcity issue for rare-meds. It also integrates an LLM into the medication recommendation process to model relationships among co-recommended medications. To further enhance the clinical reasoning, we introduce an instruction tuning step that aligns the LLM's capability with the recommendation task, enabling better handling of clinical context, including rare-meds cases. In our experiments, we show that GenRxR outperforms 14 (including 5 LLM-based) baselines in most cases. Specifically, it achieves up to 30.9% higher predictive performance for rare-meds than the strongest baseline.

cs.IR↗

SLeDGe: Semi-Supervised Learning on Data Streams with Graph Structure Learning

Semi-supervised learning (SSL) on data streams is challenging due to the continuous evolution of high-volume data and the scarcity of labels. Existing methods are limited in leveraging the intrinsic relationships among samples because they typically rely on fixed similarity measures or static graph structures, which cannot capture how relationships evolve over time. We propose SLeDGe, an SSL method for data streams that jointly learns a predictive model and an adaptive graph structure under strict memory and label constraints. SLeDGe maintains compact labeled and unlabeled memories using distinct update strategies, balancing rapid adaptation to novel features with the retention of historical consistency. In addition, by encouraging sparsity in the relational graph, SLeDGe filters out spurious connections and enables effective propagation of label supervision. Across 12 datasets, SLeDGe outperforms state-of-the-art competitors, achieving average relative accuracy gains of 31.7% with 0.1% labels and 14.8% with 1% labels.

cs.LG↗

On the Memorization Behavior of LLMs in Generative Recommendation: Observations, Implications, and Training Strategies

Generative recommendation (GR) has emerged as a promising direction for recommender systems. Recently, large language models (LLMs) have been increasingly adopted for GR, as their rich pretrained knowledge is expected to help them generalize beyond common user behavior patterns that traditional memorization-oriented baselines can capture. However, existing LLM-based GR works largely ignore LLMs' well-known tendency to memorize, which, if present in LLMs fine-tuned for GR, would restrict their utilization of pretrained knowledge. In this work, we investigate this concern by examining one-hop memorization, where a model recommends items that are direct successors of items in the training data. We show that LLMs do this more than non-LLM-based GR models-in fact, the vast majority of their gains over GR baselines are actually on users whose target items can be predicted through one-hop memorization. We intuit that improving performance on the remaining users requires LLMs to learn richer item-item relations beyond one-hop transitions. To achieve this, we propose IIRG, a novel training strategy that teaches LLMs to capture: (1) collaborative relations derived from item co-occurrences across multiple hops in user sequences, and (2) semantic relations among items with similar themes, both of which can serve as useful recommendation signals. We show that IIRG significantly improves over LLMs trained solely with standard next-item prediction, with especially large gains for users whose test items are not covered by train-time one-hop transitions.

cs.IR↗

Sequential Data Augmentation for Generative Recommendation

Generative recommendation plays a crucial role in personalized systems, predicting users' future interactions from their historical behavior sequences. A critical yet underexplored factor in training these models is data augmentation, the process of constructing training data from user interaction histories. By shaping the training distribution, data augmentation directly and often substantially affects model generalization and performance. Nevertheless, in much of the existing work, this process is simplified, applied inconsistently, or treated as a minor design choice, without a systematic and principled understanding of its effects. Motivated by our empirical finding that different augmentation strategies can yield large performance disparities, we conduct an in-depth analysis of how they reshape training distributions and influence alignment with future targets and generalization to unseen inputs. To systematize this design space, we propose GenPAS, a generalized and principled framework that models augmentation as a stochastic sampling process over input-target pairs with three bias-controlled steps: sequence sampling, target sampling, and input sampling. This formulation unifies widely used strategies as special cases and enables flexible control of the resulting training distribution. Our extensive experiments on benchmark and industrial datasets demonstrate that GenPAS yields superior accuracy, data efficiency, and parameter efficiency compared to existing strategies, providing practical guidance for principled training data construction in generative recommendation. Our code is available at https://github.com/snap-research/GenPAS.

cs.LG↗

Rethinking Contrastive Learning for Graph Collaborative Filtering: Limitations and a Simple Remedy

Graph collaborative filtering (GCF) is a dominant paradigm in recommender systems, where contrastive learning (CL) objectives such as the Sampled Softmax (SSM) loss are widely used for optimization. However, it remains unclear how CL interacts with the prediction mechanism of GCF. By unfolding the prediction mechanism of GCF, we show that the user-item prediction score is computed by aggregating learnable weights over a large number of neighbor pairs formed by the multi-hop neighbors of the user and the item. This analysis suggests that effective optimization critically depends on which neighbor pairs are upweighted during training. Empirically, we find that effective recommendation is achievable by selectively upweighting only a small subset of neighbor pairs whose constituent neighbors are structurally similar to the target user and item, and that the effect of such selective upweighting varies across different neighbor pair types. Based on these findings, we analyze SSM and identify key limitations in its neighbor pair weight update dynamics. To address these limitations, we propose NT-SSM, an effective and principled CL objective that induces type-aware neighbor pair weight update dynamics. Experiments demonstrate consistent performance improvements over SSM across multiple datasets and GCF models.

cs.IR↗

ItemRAG: Item-Based Retrieval-Augmented Generation for LLM-Based Recommendation

Recently, large language models (LLMs) have been widely used as recommender systems, owing to their reasoning capability and effectiveness in handling cold-start items. A common approach prompts an LLM with a target user's purchase history to recommend items from a candidate set, often enhanced with retrieval-augmented generation (RAG). Most existing RAG approaches retrieve purchase histories of users similar to the target user; however, these histories often contain noisy or weakly relevant information and provide little or no useful information for candidate items. To address these limitations, we propose ItemRAG, a novel RAG approach that shifts focus from coarse user-history retrieval to fine-grained item-level retrieval. ItemRAG augments the description of each item in the target user's history or the candidate set by retrieving items relevant to each. To retrieve items not merely semantically similar but informative for recommendation, ItemRAG leverages co-purchase information alongside semantic information. Especially, through their careful combination, ItemRAG prioritizes more informative retrievals and also benefits cold-start items. Through extensive experiments, we demonstrate that ItemRAG consistently outperforms existing RAG approaches under both standard and cold-start item recommendation settings. Supplementary materials, code, and datasets are provided at https://github.com/kswoo97/ItemRAG.

cs.IR↗

From Raw Features to Effective Embeddings: A Three-Stage Approach for Multimodal Recipe Recommendation

Recipe recommendation has become an essential task in web-based food platforms. A central challenge is effectively leveraging rich multimodal features beyond user-recipe interactions. Our analysis shows that even simple uses of multimodal signals yield competitive performance, suggesting that systematic enhancement of these signals is highly promising. We propose TESMR, a 3-stage framework for recipe recommendation that progressively refines raw multimodal features into effective embeddings through: (1) content-based enhancement using foundation models with multimodal comprehension, (2) relation-based enhancement via message propagation over user-recipe interactions, and (3) learning-based enhancement through contrastive learning with learnable embeddings. Experiments on two real-world datasets show that TESMR outperforms existing methods, achieving 7-15% higher Recall@10.

cs.LG↗

Hybrid-Vector Retrieval for Visually Rich Documents: Combining Single-Vector Efficiency and Multi-Vector Accuracy

Retrieval over visually rich documents is essential for tasks such as legal discovery, scientific search, and enterprise knowledge management. Existing approaches fall into two paradigms: single-vector retrieval, which is efficient but coarse, and multi-vector retrieval, which is accurate but computationally expensive. To address this trade-off, we propose HEAVEN, a plug-and-play two-stage hybrid-vector framework. In the first stage, HEAVEN efficiently retrieves candidate pages using a single-vector method over Visually-Summarized Pages (VS-Pages), which assemble representative visual layouts from multiple pages. In the second stage, it reranks candidates with a multi-vector method while filtering query tokens by linguistic importance to reduce redundant computations. To evaluate retrieval systems under realistic conditions, we also introduce ViMDoc, a benchmark for visually rich, multi-document, and long-document retrieval. Across four benchmarks, HEAVEN attains 99.87% of the Recall@1 performance of multi-vector models on average while reducing per-query computation by 99.82%, achieving efficiency and accuracy. Our code and datasets are available at: https://github.com/juyeonnn/HEAVEN

cs.IR↗

TimeXL: Explainable Multi-modal Time Series Prediction with LLM-in-the-Loop

Time series analysis provides essential insights for real-world system dynamics and informs downstream decision-making, yet most existing methods often overlook the rich contextual signals present in auxiliary modalities. To bridge this gap, we introduce TimeXL, a multi-modal prediction framework that integrates a prototype-based time series encoder with three collaborating Large Language Models (LLMs) to deliver more accurate predictions and interpretable explanations. First, a multi-modal prototype-based encoder processes both time series and textual inputs to generate preliminary forecasts alongside case-based rationales. These outputs then feed into a prediction LLM, which refines the forecasts by reasoning over the encoder's predictions and explanations. Next, a reflection LLM compares the predicted values against the ground truth, identifying textual inconsistencies or noise. Guided by this feedback, a refinement LLM iteratively enhances text quality and triggers encoder retraining. This closed-loop workflow-prediction, critique (reflect), and refinement-continuously boosts the framework's performance and interpretability. Empirical evaluations on four real-world datasets demonstrate that TimeXL achieves up to 8.9% improvement in AUC and produces human-centric, multi-modal explanations, highlighting the power of LLM-driven reasoning for time series prediction.

cs.LG↗

Effective Dataset Distillation for Spatio-Temporal Forecasting with Bi-dimensional Compression

Spatio-temporal time series are widely used in real-world applications, including traffic prediction and weather forecasting. They are sequences of observations over extensive periods and multiple locations, naturally represented as multidimensional data. Forecasting is a central task in spatio-temporal analysis, and numerous deep learning methods have been developed to address it. However, as dataset sizes and model complexities continue to grow in practice, training deep learning models has become increasingly time- and resource-intensive. A promising solution to this challenge is dataset distillation, which synthesizes compact datasets that can effectively replace the original data for model training. Although successful in various domains, including time series analysis, existing dataset distillation methods compress only one dimension, making them less suitable for spatio-temporal datasets, where both spatial and temporal dimensions jointly contribute to the large data volume. To address this limitation, we propose STemDist, the first dataset distillation method specialized for spatio-temporal time series forecasting. A key idea of our solution is to compress both temporal and spatial dimensions in a balanced manner, reducing training time and memory. We further reduce the distillation cost by performing distillation at the cluster level rather than the individual location level, and we complement this coarse-grained approach with a subset-based granular distillation technique that enhances forecasting performance. On five real-world datasets, we show empirically that, compared to both general and time-series dataset distillation methods, datasets distilled by our STemDist method enable model training (1) faster (up to 6X) (2) more memory-efficient (up to 8X), and (3) more effective (with up to 12% lower prediction error).

cs.LG↗