Abstract:Message-passing neural networks (MPNNs) often suffer from an information bottleneck when capturing long-range dependencies, leading to the oversquashing (OSQ) phenomenon. Alongside spatial connectivity enrichment (e.g., rewiring), recent studies have shown that spectral filtering can yield strong long-range learning outcomes, as spectral operators enable global information mixing that alleviates OSQ. These approaches achieve this either by stabilizing the Jacobian energies in deep propagation or by guaranteeing OSQ mitigation under strong theoretical assumptions. We revisit these conclusions and show that the associated Jacobian sensitivity lower bound is generally difficult to achieve in practice. We then propose S$^3$GNN, which mitigates OSQ without such restrictive assumptions by lightweightly reintroducing omitted components with substantially lower computational complexity, while standard stability constraints on feature transformations remain effective under our new dynamics. Extensive experiments across diverse domains (e.g., long-range benchmarks, KGQA, and mesh-based fluid dynamics) demonstrate that S$^3$GNN achieves up to an order-of-magnitude error reduction with up to 50\% fewer parameters. Our code can be found in https://github.com/EEthanShi/S3-GNN.git.
Abstract:Orthogonal parameter-efficient fine-tuning (PEFT) adapts pretrained weights through structure-preserving multiplicative transformations, but existing methods often conflate two distinct design choices: the subspace in which adaptation occurs and the transformation applied within that subspace. This paper introduces LOFT, a low-rank orthogonal fine-tuning framework that explicitly separates these two components. By viewing orthogonal adaptation as a multiplicative subspace rotation, LOFT provides a unified formulation that recovers representative orthogonal PEFT methods, including coordinate-, butterfly-, Householder-, and principal-subspace-based variants. More importantly, this perspective exposes support selection as a central design axis rather than a byproduct of a particular parameterization. We develop a first-order analysis showing that useful adaptation supports should be informed by the downstream training signal, motivating practical task-aware support selection strategies. Across language understanding, visual transfer, mathematical reasoning, and multilingual out-of-distribution adaptation, LOFT recovers principal-subspace orthogonal adaptation while gradient-informed supports improve the efficiency-performance trade-off under matched parameter, memory, and compute budgets. These results suggest that principled support selection is an important direction for improving orthogonal PEFT.
Abstract:In the classical identification in the limit model of Gold [1967], a stream of positive examples is presented round by round, and the learner must eventually recover the target hypothesis. Recently, Kleinberg and Mullainathan [2024] introduced generation in the limit, where the learner instead must eventually output novel elements of the target's support. Both lines of work focus on positive-only or fully labeled data. Yet many natural supervision signals are inherently relational rather than singleton, which encode relationships between examples rather than labels of individual ones. We initiate the study of contrastive identification and generation in the limit, where the learner observes a contrastive presentation of data: a stream of unordered pairs $\{x,y\}$ satisfying $h(x)\ne h(y)$ for an unknown target binary hypothesis $h$, but which element is positive is hidden from the learner. We first present three results in the noiseless setting: an exact characterization of contrastive identifiable classes (a one-line geometric refinement of Angluin [1980]'s tell-tale condition), a combinatorial dimension called contrastive closure dimension (a contrasitive analogue of the closure dimension in Raman et al. [2025]) and exactly characterizing uniform contrastive generation with tight sample complexity, and a strict hierarchy in which contrastive generation and text identification are mutually incomparable. We then prove a sharp reversal under finite adversarial corruption: there exist classes identifiable from contrastive pairs under any finite corruption budget by a single budget-independent algorithm, yet not identifiable from positive examples under even one corrupted observation. The unifying technical object is the common crossing graph, which encodes pairwise ambiguity, family-level generation obstructions, and corruption defects in a single coverage-and-incidence language.
Abstract:As large language models (LLMs) are increasingly trained on sensitive user data, understanding the fundamental cost of privacy in language learning becomes essential. We initiate the study of differentially private (DP) language identification and generation in the agnostic statistical setting, establishing algorithms and matching lower bounds that precisely quantify the cost of privacy. For both tasks, approximate $(\varepsilon, δ)$-DP with constant $\varepsilon > 0$ recovers the non-private error rates: $\exp(-r(n))$ for identification (for any $r(n) = o(n)$) and $\exp(-Ω(n))$ for generation. Under pure $\varepsilon$-DP, the exponents degrade by a multiplicative factor of $\min\{1, \varepsilon\}$, which we show is tight up to constants. Notably, for generation under pure DP with mild assumptions, the upper bound $\exp(-\min\{1,\varepsilon\} \cdot Ω(n))$ matches the lower bound up to some constants, establishing an optimal rate. Our results show that the cost of privacy in language learning is surprisingly mild: absent entirely under approximate DP, and exactly a $\min\{1,\varepsilon\}$ factor in the exponent under pure DP.
Abstract:In this paper, we explore how our recently developed Wiener Chaos Expansion (WCE)-based neural operator (NO) can be applied to singular stochastic partial differential equations, e.g., the dynamic $\boldsymbolΦ^4_2$ model simulated in the recent works. Unlike the previous WCE-NO which solves SPDEs by simply inserting Wick-Hermite features into the backbone NO model, we leverage feature-wise linear modulation (FiLM) to appropriately capture the dependency between the solution of singular SPDE and its smooth remainder. The resulting WCE-FiLM-NO shows excellent performance on $\boldsymbolΦ^4_2$, as measured by relative $L_2$ loss, out-of-distribution $L_2$ loss, and autocorrelation score; all without the help of renormalisation factor. In addition, we also show the potential of simulating $\boldsymbolΦ^4_3$ data, which is more aligned with real scientific practice in statistical quantum field theory. To the best of our knowledge, this is among the first works to develop an efficient data-driven surrogate for the dynamical $\boldsymbolΦ^4_3$ model.
Abstract:Stochastic differential equations (SDEs) and stochastic partial differential equations (SPDEs) are fundamental tools for modeling stochastic dynamics across the natural sciences and modern machine learning. Developing deep learning models for approximating their solution operators promises not only fast, practical solvers, but may also inspire models that resolve classical learning tasks from a new perspective. In this work, we build on classical Wiener chaos expansions (WCE) to design neural operator (NO) architectures for SPDEs and SDEs: we project the driving noise paths onto orthonormal Wick Hermite features and parameterize the resulting deterministic chaos coefficients with neural operators, so that full solution trajectories can be reconstructed from noise in a single forward pass. On the theoretical side, we investigate the classical WCE results for the class of multi-dimensional SDEs and semilinear SPDEs considered here by explicitly writing down the associated coupled ODE/PDE systems for their chaos coefficients, which makes the separation between stochastic forcing and deterministic dynamics fully explicit and directly motivates our model designs. On the empirical side, we validate our models on a diverse suite of problems: classical SPDE benchmarks, diffusion one-step sampling on images, topological interpolation on graphs, financial extrapolation, parameter estimation, and manifold SDEs for flood prediction, demonstrating competitive accuracy and broad applicability. Overall, our results indicate that WCE-based neural operators provide a practical and scalable way to learn SDE/SPDE solution operators across diverse domains.




Abstract:Supervised learning relies on high-quality labeled data, but obtaining such data through human annotation is both expensive and time-consuming. Recent work explores using large language models (LLMs) for annotation, but LLM-generated labels still fall short of human-level quality. To address this problem, we propose the Annotation with Critical Thinking (ACT) data pipeline, where LLMs serve not only as annotators but also as judges to critically identify potential errors. Human effort is then directed towards reviewing only the most "suspicious" cases, significantly improving the human annotation efficiency. Our major contributions are as follows: (1) ACT is applicable to a wide range of domains, including natural language processing (NLP), computer vision (CV), and multimodal understanding, by leveraging multimodal-LLMs (MLLMs). (2) Through empirical studies, we derive 7 insights on how to enhance annotation quality while efficiently reducing the human cost, and then translate these findings into user-friendly guidelines. (3) We theoretically analyze how to modify the loss function so that models trained on ACT data achieve similar performance to those trained on fully human-annotated data. Our experiments show that the performance gap can be reduced to less than 2% on most benchmark datasets while saving up to 90% of human costs.




Abstract:Understanding disease progression at the molecular pathway level usually requires capturing both structural dependencies between pathways and the temporal dynamics of disease evolution. In this work, we solve the former challenge by developing a biologically informed graph-forming method to efficiently construct pathway graphs for subjects from our newly curated JR5558 mouse transcriptomics dataset. We then develop Graph-level Pseudotime Analysis (GPA) to infer graph-level trajectories that reveal how disease progresses at the population level, rather than in individual subjects. Based on the trajectories estimated by GPA, we identify the most sensitive pathways that drive disease stage transitions. In addition, we measure changes in pathway features using neural stochastic differential equations (SDEs), which enables us to formally define and compute pathway stability and disease bifurcation points (points of no return), two fundamental problems in disease progression research. We further extend our theory to the case when pathways can interact with each other, enabling a more comprehensive and multi-faceted characterization of disease phenotypes. The comprehensive experimental results demonstrate the effectiveness of our framework in reconstructing the dynamics of the pathway, identifying critical transitions, and providing novel insights into the mechanistic understanding of disease evolution.




Abstract:Graph Neural Networks (GNNs) have demonstrated remarkable effectiveness in various graph representation learning tasks. However, most existing GNNs focus primarily on capturing local information through explicit graph convolution, often neglecting global message-passing. This limitation hinders the establishment of a collaborative interaction between global and local information, which is crucial for comprehensively understanding graph data. To address these challenges, we propose a novel framework called Comprehensive Graph Representation Learning (ComGRL). ComGRL integrates local information into global information to derive powerful representations. It achieves this by implicitly smoothing local information through flexible graph contrastive learning, ensuring reliable representations for subsequent global exploration. Then ComGRL transfers the locally derived representations to a multi-head self-attention module, enhancing their discriminative ability by uncovering diverse and rich global correlations. To further optimize local information dynamically under the self-supervision of pseudo-labels, ComGRL employs a triple sampling strategy to construct mixed node pairs and applies reliable Mixup augmentation across attributes and structure for local contrastive learning. This approach broadens the receptive field and facilitates coordination between local and global representation learning, enabling them to reinforce each other. Experimental results across six widely used graph datasets demonstrate that ComGRL achieves excellent performance in node classification tasks. The code could be available at https://github.com/JinluWang1002/ComGRL.




Abstract:Radiology report generation (RRG) models typically focus on individual exams, often overlooking the integration of historical visual or textual data, which is crucial for patient follow-ups. Traditional methods usually struggle with long sequence dependencies when incorporating historical information, but large language models (LLMs) excel at in-context learning, making them well-suited for analyzing longitudinal medical data. In light of this, we propose a novel Historical-Constrained Large Language Models (HC-LLM) framework for RRG, empowering LLMs with longitudinal report generation capabilities by constraining the consistency and differences between longitudinal images and their corresponding reports. Specifically, our approach extracts both time-shared and time-specific features from longitudinal chest X-rays and diagnostic reports to capture disease progression. Then, we ensure consistent representation by applying intra-modality similarity constraints and aligning various features across modalities with multimodal contrastive and structural constraints. These combined constraints effectively guide the LLMs in generating diagnostic reports that accurately reflect the progression of the disease, achieving state-of-the-art results on the Longitudinal-MIMIC dataset. Notably, our approach performs well even without historical data during testing and can be easily adapted to other multimodal large models, enhancing its versatility.