Xiao Qin

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.

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.

Libo Sun, Po-wei Harn, Peixiong He et al.

Mixture-of-Experts (MoE) networks promise favorable accuracy-compute trade-offs, yet practical vision deployments are hindered by expert collapse and limited end-to-end efficiency gains. We study when sparse top-$k$ routing with hard capacity constraints helps in vision classification, evaluated under multi-seed protocols on four benchmarks (CIFAR-10/100, Tiny-ImageNet, ImageNet-1K). We observe a \emph{compute-leverage pattern}: positive accuracy gaps require a substantial fraction $ρ$ of total FLOPs to be routed; at ImageNet scale this is necessary but not sufficient, as multi-expert routing ($k \geq 2$) is additionally required. Two controlled experiments isolate these factors. A hidden-size sweep on CIFAR-10 yields both predicted sign reversals across standard and depthwise backbones, ruling out backbone family as the active variable. An ImageNet-1K ablation that varies only top-$k$ -- holding architecture, initialization, and $ρ$ fixed -- reverses the gap from positive to negative across all five seeds. A per-sample variant of Soft MoE that softmaxes over experts rather than the batch rescues CIFAR-100 above the dense baseline, identifying batch-axis dispatch as the dominant failure mode in per-sample CNN settings. Code and aggregate results: https://github.com/libophd/sparse-moe-vision-rho.

Asim Biswal, Chuan Lei, Xiao Qin et al.

Recent advances in LLM-based Text-to-SQL have achieved remarkable gains on public benchmarks such as BIRD and Spider. Yet, these systems struggle to scale in realistic enterprise settings with large, complex schemas, diverse SQL dialects, and expensive multi-step reasoning. Emerging agentic approaches show potential for adaptive reasoning but often suffer from inefficiency and instability-repeating interactions with databases, producing inconsistent outputs, and occasionally failing to generate valid answers. To address these challenges, we introduce Agent Semantic Memory (AgentSM), an agentic framework for Text-to-SQL that builds and leverages interpretable semantic memory. Instead of relying on raw scratchpads or vector retrieval, AgentSM captures prior execution traces-or synthesizes curated ones-as structured programs that directly guide future reasoning. This design enables systematic reuse of reasoning paths, which allows agents to scale to larger schemas, more complex questions, and longer trajectories efficiently and reliably. Compared to state-of-the-art systems, AgentSM achieves higher efficiency by reducing average token usage and trajectory length by 25% and 35%, respectively, on the Spider 2.0 benchmark. It also improves execution accuracy, reaching a state-of-the-art accuracy of 44.8% on the Spider 2.0 Lite benchmark.

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 .

Libo Sun, Peixiong He, Po-Wei Harn et al.

KV cache memory is the dominant bottleneck for long-context LLM inference. Existing compression methods each act on a single axis of the four-dimensional KV tensor -- token eviction (sequence), quantization (precision), low-rank projection (head dimension), or cross-layer sharing -- but apply the same recipe to every layer. We show that this homogeneity leaves accuracy on the table: different layers respond very differently to each compression operation, and the optimal per-layer mix of eviction and quantization is far from uniform. We propose MoE-nD, a mixture-of-experts framework that routes each layer to its own (eviction-ratio, K-bits, V-bits) tuple under a global memory budget. An offline-calibrated greedy solver chooses the routing that minimizes predicted quality loss; at inference time, per-layer heterogeneous eviction and quantization are applied jointly through a single attention patch. On a 4-task subset of LongBench-v1 (16k inputs, n=50 per task, adapted reasoning-model protocol; see section Experiments), MoE-nD's hetero variant matches our uncompressed 1.9~GB baseline at 14x compression (136~MB) while every other compressed baseline we tested (1d, 2d_uniform, 2d) at comparable or smaller memory stays under 8/100. The gains hold on AIME reasoning benchmarks (+6 to +27 pts over the strongest per-layer-quantization baseline across eight configurations). Two null results -- MATH-500 and LongBench's TREC -- share a principled cause (short inputs, solver picks keep=1.0 on most layers), cleanly characterizing when per-layer eviction routing has headroom to help.

Libo Sun, Po-wei Harn, Peixiong He et al.

KV-cache compression at small budgets is a crowded design space spanning cache representation, head-wise routing, compression cadence, decoding behavior, and within-budget scoring. We study seven mechanisms across these five families under matched mean cache on long-form mathematical reasoning (MATH-500~\cite{hendrycks2021math}) with two distilled-reasoning models (Qwen-7B and Llama-8B variants of DeepSeek-R1-Distill~\cite{deepseek2025r1}) at budgets $b \in \{64, 128\}$. All seven were rejected. We then propose $α$, a one-function modification to the TriAttention~\cite{mao2026triattention} retention scorer that replaces argmax-top-$k$ with greedy facility-location-inspired selection under a V-space redundancy penalty controlled by a single weight $λ$. A pre-registered protocol tunes $λ$ on a frozen development split and confirms on a disjoint held-out split; with $λ= 0.5$, $α$ clears Bonferroni on two of the four (model, budget) cells (Qwen $b{=}128$ and Llama $b{=}64$), no cell is significantly negative, and the pre-registered Branch~A triggers. The finding is asymmetric: a minimal scoring modification beat heavier structural redesigns in this regime, and the combined matched-memory, sympy-graded, held-out confirmation protocol is the evidence standard that made the asymmetry visible.

Xiao Qin, Xingyi Song, Tong Liu et al.

We present LoRM (Language of Rotating Machinery), a self-supervised framework for multi-modal rotating-machinery signal understanding and real-time condition monitoring. LoRM is built on the idea that rotating-machinery signals can be viewed as a machine language: local signals can be tokenised into discrete symbolic units, and their future evolution can be predicted from observed multi-sensor context. Unlike conventional signal-processing methods that rely on hand-crafted transforms and features, LoRM reformulates multi-modal sensor data as a token-based sequence-prediction problem. For each data window, the observed context segment is retained in continuous form, while the future target segment of each sensing channel is quantised into a discrete token. Then, efficient knowledge transfer is achieved by partially fine-tuning a general-purpose pre-trained language model on industrial signals, avoiding the need to train a large model from scratch. Finally, condition monitoring is performed by tracking token-prediction errors as a health indicator, where increasing errors indicate degradation. In-situ tool condition monitoring (TCM) experiments demonstrate stable real-time tracking and strong cross-tool generalisation, showing that LoRM provides a practical bridge between language modelling and industrial signal analysis. The source code is publicly available at https://github.com/Q159753258/LormPHM.

Yue Gong, Chuan Lei, Xiao Qin et al.

Text-to-SQL systems translate natural language (NL) questions into SQL queries, enabling non-technical users to interact with structured data. While large language models (LLMs) have shown promising results on the text-to-SQL task, they often produce semantically incorrect yet syntactically valid queries, with limited insight into their reliability. We propose SQLens, an end-to-end framework for fine-grained detection and correction of semantic errors in LLM-generated SQL. SQLens integrates error signals from both the underlying database and the LLM to identify potential semantic errors within SQL clauses. It further leverages these signals to guide query correction. Empirical results on two public benchmarks show that SQLens outperforms the best LLM-based self-evaluation method by 25.78% in F1 for error detection, and improves execution accuracy of out-of-the-box text-to-SQL systems by up to 20%.

Kapil Vaidya, Jialin Ding, Sebastian Kosak et al.

NL2SQL (natural language to SQL) translates natural language questions into SQL queries, thereby making structured data accessible to non-technical users, serving as the foundation for intelligent data applications. State-of-the-art NL2SQL techniques typically perform translation by retrieving database-specific information, such as the database schema, and invoking a pre-trained large language model (LLM) using the question and retrieved information to generate the SQL query. However, existing NL2SQL techniques miss a key opportunity which is present in real-world settings: NL2SQL is typically applied on existing databases which have already served many SQL queries in the past. The past query workload implicitly contains information which is helpful for accurate NL2SQL translation and is not apparent from the database schema alone, such as common join paths and the semantics of obscurely-named tables and columns. We introduce TailorSQL, a NL2SQL system that takes advantage of information in the past query workload to improve both the accuracy and latency of translating natural language questions into SQL. By specializing to a given workload, TailorSQL achieves up to 2$\times$ improvement in execution accuracy on standardized benchmarks.

Longwei Wang, Ifrat Ikhtear Uddin, KC Santosh et al.

Adversarial examples reveal critical vulnerabilities in deep neural networks by exploiting their sensitivity to imperceptible input perturbations. While adversarial training remains the predominant defense strategy, it often incurs significant computational cost and may compromise clean-data accuracy. In this work, we investigate an architectural approach to adversarial robustness by embedding group-equivariant convolutions-specifically, rotation- and scale-equivariant layers-into standard convolutional neural networks (CNNs). These layers encode symmetry priors that align model behavior with structured transformations in the input space, promoting smoother decision boundaries and greater resilience to adversarial attacks. We propose and evaluate two symmetry-aware architectures: a parallel design that processes standard and equivariant features independently before fusion, and a cascaded design that applies equivariant operations sequentially. Theoretically, we demonstrate that such models reduce hypothesis space complexity, regularize gradients, and yield tighter certified robustness bounds under the CLEVER (Cross Lipschitz Extreme Value for nEtwork Robustness) framework. Empirically, our models consistently improve adversarial robustness and generalization across CIFAR-10, CIFAR-100, and CIFAR-10C under both FGSM and PGD attacks, without requiring adversarial training. These findings underscore the potential of symmetry-enforcing architectures as efficient and principled alternatives to data augmentation-based defenses.

Chao Deng, Xiaosen Li, Xiao Qin

The nnUNet segmentation framework adeptly adjusts most hyperparameters in training scripts automatically, but it overlooks the tuning of internal hyperparameters within the segmentation network itself, which constrains the model's ability to generalize. Addressing this limitation, this study presents a novel Self-Adaptive Convolution Module that dynamically adjusts the size of the convolution kernels depending on the unique fingerprints of different datasets. This adjustment enables the MSA2-Net, when equipped with this module, to proficiently capture both global and local features within the feature maps. Self-Adaptive Convolution Module is strategically integrated into two key components of the MSA2-Net: the Multi-Scale Convolution Bridge and the Multi-Scale Amalgamation Decoder. In the MSConvBridge, the module enhances the ability to refine outputs from various stages of the CSWin Transformer during the skip connections, effectively eliminating redundant data that could potentially impair the decoder's performance. Simultaneously, the MSADecoder, utilizing the module, excels in capturing detailed information of organs varying in size during the decoding phase. This capability ensures that the decoder's output closely reproduces the intricate details within the feature maps, thus yielding highly accurate segmentation images. MSA2-Net, bolstered by this advanced architecture, has demonstrated exceptional performance, achieving Dice coefficient scores of 86.49\%, 92.56\%, 93.37\%, and 92.98\% on the Synapse, ACDC, Kvasir, and Skin Lesion Segmentation (ISIC2017) datasets, respectively. This underscores MSA2-Net's robustness and precision in medical image segmentation tasks across various datasets.

Kapil Vaidya, Abishek Sankararaman, Jialin Ding et al.

NL2SQL (natural language to SQL) systems translate natural language into SQL queries, allowing users with no technical background to interact with databases and create tools like reports or visualizations. While recent advancements in large language models (LLMs) have significantly improved NL2SQL accuracy, schema ambiguity remains a major challenge in enterprise environments with complex schemas, where multiple tables and columns with semantically similar names often co-exist. To address schema ambiguity, we introduce ODIN, a NL2SQL recommendation engine. Instead of producing a single SQL query given a natural language question, ODIN generates a set of potential SQL queries by accounting for different interpretations of ambiguous schema components. ODIN dynamically adjusts the number of suggestions based on the level of ambiguity, and ODIN learns from user feedback to personalize future SQL query recommendations. Our evaluation shows that ODIN improves the likelihood of generating the correct SQL query by 1.5-2$\times$ compared to baselines.

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.

Nasrullah Sheikh, Xiao Qin, Berthold Reinwald et al.

Developing scalable solutions for training Graph Neural Networks (GNNs) for link prediction tasks is challenging due to the high data dependencies which entail high computational cost and huge memory footprint. We propose a new method for scaling training of knowledge graph embedding models for link prediction to address these challenges. Towards this end, we propose the following algorithmic strategies: self-sufficient partitions, constraint-based negative sampling, and edge mini-batch training. Both, partitioning strategy and constraint-based negative sampling, avoid cross partition data transfer during training. In our experimental evaluation, we show that our scaling solution for GNN-based knowledge graph embedding models achieves a 16x speed up on benchmark datasets while maintaining a comparable model performance as non-distributed methods on standard metrics.

Alina Vretinaris, Chuan Lei, Vasilis Efthymiou et al.

Medical knowledge bases (KBs), distilled from biomedical literature and regulatory actions, are expected to provide high-quality information to facilitate clinical decision making. Entity disambiguation (also referred to as entity linking) is considered as an essential task in unlocking the wealth of such medical KBs. However, existing medical entity disambiguation methods are not adequate due to word discrepancies between the entities in the KB and the text snippets in the source documents. Recently, graph neural networks (GNNs) have proven to be very effective and provide state-of-the-art results for many real-world applications with graph-structured data. In this paper, we introduce ED-GNN based on three representative GNNs (GraphSAGE, R-GCN, and MAGNN) for medical entity disambiguation. We develop two optimization techniques to fine-tune and improve ED-GNN. First, we introduce a novel strategy to represent entities that are mentioned in text snippets as a query graph. Second, we design an effective negative sampling strategy that identifies hard negative samples to improve the model's disambiguation capability. Compared to the best performing state-of-the-art solutions, our ED-GNN offers an average improvement of 7.3% in terms of F1 score on five real-world datasets.

Nasrullah Sheikh, Xiao Qin, Berthold Reinwald et al.

Knowledge graph embedding methods learn embeddings of entities and relations in a low dimensional space which can be used for various downstream machine learning tasks such as link prediction and entity matching. Various graph convolutional network methods have been proposed which use different types of information to learn the features of entities and relations. However, these methods assign the same weight (importance) to the neighbors when aggregating the information, ignoring the role of different relations with the neighboring entities. To this end, we propose a relation-aware graph attention model that leverages relation information to compute different weights to the neighboring nodes for learning embeddings of entities and relations. We evaluate our proposed approach on link prediction and entity matching tasks. Our experimental results on link prediction on three datasets (one proprietary and two public) and results on unsupervised entity matching on one proprietary dataset demonstrate the effectiveness of the relation-aware attention.

Xiao Qin, Nasrullah Sheikh, Berthold Reinwald et al.

This paper describes an end-to-end solution for the relationship prediction task in heterogeneous, multi-relational graphs. We particularly address two building blocks in the pipeline, namely heterogeneous graph representation learning and negative sampling. Existing message passing-based graph neural networks use edges either for graph traversal and/or selection of message encoding functions. Ignoring the edge semantics could have severe repercussions on the quality of embeddings, especially when dealing with two nodes having multiple relations. Furthermore, the expressivity of the learned representation depends on the quality of negative samples used during training. Although existing hard negative sampling techniques can identify challenging negative relationships for optimization, new techniques are required to control false negatives during training as false negatives could corrupt the learning process. To address these issues, first, we propose RelGNN -- a message passing-based heterogeneous graph attention model. In particular, RelGNN generates the states of different relations and leverages them along with the node states to weigh the messages. RelGNN also adopts a self-attention mechanism to balance the importance of attribute features and topological features for generating the final entity embeddings. Second, we introduce a parameter-free negative sampling technique -- adaptive self-adversarial (ASA) negative sampling. ASA reduces the false-negative rate by leveraging positive relationships to effectively guide the identification of true negative samples. Our experimental evaluation demonstrates that RelGNN optimized by ASA for relationship prediction improves state-of-the-art performance across established benchmarks as well as on a real industrial dataset.