eigenvector
AGeometric Analysis of PCA
What property of the data distribution determines the excess risk of principal component analysis? In this paper, we provide a precise answer to this question. We establish a central limit theorem for the error of the principal subspace estimated by PCA, and derive the asymptotic distribution of its excess risk under the reconstruction loss. We obtain a non-asymptotic upper bound on the excess risk of PCA that recovers, in the large sample limit, our asymptotic characterization. Underlying our contributions is the following result: we prove that the negative block Rayleigh quotient, defined on the Grassmannian, is generalized self-concordant along geodesics emanating from its minimizer of maximum rotation less than π/4.
Novel Exploration via Orthogonality
Efficient exploration remains one of the most important open problems in reinforcement learning. Discovering novel states or transitions requires policies that efficiently direct the agent away from the regions of the state space that are already well explored. We introduce Novel Exploration via Orthogonality (NEO), an approach that automatically uncovers not only which regions of the environment are novel but also how to reach them by leveraging Laplacian representations. NEO uses the eigenvectors of a modified graph Laplacian to induce gradient flows from states that are frequently visited (less novel) to states that are seldom visited (more novel). We show that NEO's modified Laplacian yields eigenvectors whose extreme values align with the most novel regions of the state space. We provide bounds for the eigenvalues of the modified Laplacian; and we show that the smoothest eigenvectors with real eigenvalues below certain thresholds provide guaranteed gradients to novel states for both undirected and directed graphs. In an empirical evaluation in online, incremental settings, NEO outperformed related state-of-theart approaches, including eigen-options and cover options, in a large collection of undirected and directed environments with varying connectivity structures.
Subgraph Federated Learning via Spectral Methods
We consider the problem of federated learning (FL) with graph-structured data distributed across multiple clients. In particular, we address the prevalent scenario of interconnected subgraphs, where interconnections between clients significantly influence the learning process. Existing approaches suffer from critical limitations, either requiring the exchange of sensitive node embeddings, thereby posing privacy risks, or relying on computationally-intensive steps, which hinders scalability. To tackle these challenges, we propose FEDLAP, a novel framework that leverages global structure information via Laplacian smoothing in the spectral domain to effectively capture inter-node dependencies while ensuring privacy and scalability. We provide a formal analysis of the privacy of FEDLAP, demonstrating that it preserves privacy. Notably, FEDLAP is the first subgraph FL scheme with strong privacy guarantees. Extensive experiments on benchmark datasets demonstrate that FEDLAP achieves competitive or superior utility compared to existing techniques.
Seeds of Structure: Patch PCAReveals Universal Compositional Cues in Diffusion Models
Diffusion models transform random noise into images of remarkable fidelity, yet the structure of this noise-to-image map remains largely unexplored. We investigate this relationship using patch-wise Principal Component Analysis (PCA) and empirically demonstrate that low-frequency components of the initial noise predominantly influence the compositional structure of generated images. Our analyses reveal that noise seeds inherently contain universal compositional cues, evident when identical seeds produce images with similar structural attributes across different datasets and model architectures. Leveraging these insights, we develop and theoretically justify a simple yet effective Patch PCA denoiser that extracts underlying structure from noise using only generic natural image statistics. The robustness of these structural cues is observed to persist across both pixel-space models and latent diffusion models, highlighting their fundamental nature. Finally, we introduce a zero-shot editing method that enables injecting compositional control over generated images, providing an intuitive approach to guided generation without requiring model fine-tuning or additional training.
Semi-supervised Vertex Hunting, with Applications in Network and Text Analysis
Vertex hunting (VH) is the task of estimating a simplex from noisy data points and has many applications in areas such as network and text analysis. We introduce a new variant, semi-supervised vertex hunting (SSVH), in which partial information is available in the form of barycentric coordinates for some data points, known only up to an unknown transformation. To address this problem, we develop a method that leverages properties of orthogonal projection matrices, drawing on novel insights from linear algebra. We establish theoretical error bounds for our method and demonstrate that it achieves a faster convergence rate than existing unsupervised VH algorithms. Finally, we apply SSVH to two practical settings-- semi-supervised network mixed membership estimation and semi-supervised topic modeling--resulting in efficient and scalable algorithms.
Spectral Graph Neural Networks are Incomplete on Graphs with a Simple Spectrum
Spectral features are widely incorporated within Graph Neural Networks (GNNs) to improve their expressive power, or their ability to distinguish among nonisomorphic graphs. One popular example is the usage of graph Laplacian eigenvectors for positional encoding in MPNNs and Graph Transformers. The expressive power of such Spectrally-enhanced GNNs (SGNNs) is usually evaluated via the k-WL graph isomorphism test hierarchy and homomorphism counting. Yet, these frameworks align poorly with the graph spectra, yielding limited insight into SGNNs' expressive power. In this paper, we leverage a well-studied paradigm of classifying graphs by their largest eigenvalue multiplicity to introduce an expressivity hierarchy for SGNNs. We then prove that many SGNNs are incomplete even on graphs with distinct eigenvalues. To mitigate this deficiency, we adapt rotation equivariant neural networks to the graph spectra setting, yielding equiEPNN, a novel SGNN that provably improves upon contemporary SGNNs' expressivity on simple spectrum graphs. We then demonstrate that equiEPNN achieves perfect eigenvector canonicalization on ZINC, and performs favorably on image classification on MNIST-Superpixel and graph property regression on ZINC, compared to leading spectral methods.
9a648e8e1014c2427156dcb5465cd488-Supplemental-Datasets_and_Benchmarks_Track.pdf
AResults883 In Table 4, we show a summary of the results of AlgoTuner for each of the four frontier models tests.884 Speedup percentage is calculated as the percentage of tasks for which AlgoTuner gets at least a 1.1 speedup. Speedup is calculated as the ratio between the reference solve function's time and the LM-generated solve function's time. The LM receives an initial message, consisting of general instructions on how to888 use the system (see C.1), Numba (Lam et al., 2015), Dask (Rocklin, 2015), and Cython (Behnel et al.,889 2011) (for a full list see Appendix E). Additionally, the LM is given the task's description, which890 includes input and output descriptions and examples, as well as the task's solveand is_solution891 functions.
Robustly Learning Monotone Single-Index Models
We consider the basic problem of learning Single-Index Models with respect to the square loss under the Gaussian distribution in the presence of adversarial label noise. Our main contribution is the first computationally efficient algorithm for this learning task, achieving a constant factor approximation, that succeeds for the class of all monotone activations with bounded moment of order 2 + ζ, for ζ > 0. This class in particular includes all monotone Lipschitz functions and even discontinuous functions like (possibly biased) halfspaces. Prior work for the case of unknown activation either does not attain constant factor approximation or succeeds for a substantially smaller family of activations. The main conceptual novelty of our approach lies in developing an optimization framework that steps outside the boundaries of usual gradient methods and instead identifies a useful vector field to guide the algorithm updates by directly leveraging the problem structure, properties of Gaussian spaces, and regularity of monotone functions.
Reward-Aware Proto-Representations in Reinforcement Learning
In recent years, the successor representation (SR) has attracted increasing attention in reinforcement learning (RL), and it has been used to address some of its key challenges, such as exploration, credit assignment, and generalization. The SR can be seen as representing the underlying credit assignment structure of the environment by implicitly encoding its induced transition dynamics. However, the SR is reward-agnostic. In this paper, we discuss a similar representation that also takes into account the reward dynamics of the problem. We study the default representation (DR), a recently proposed representation with limited theoretical (and empirical) analysis. Here, we lay some of the theoretical foundation underlying the DR in the tabular case by (1) deriving dynamic programming and (2) temporaldifference methods to learn the DR, (3) characterizing the basis for the vector space of the DR, and (4) formally extending the DR to the function approximation case through default features. Empirically, we analyze the benefits of the DR in many of the settings in which the SR has been applied, including (1) reward shaping, (2) option discovery, (3) exploration, and (4) transfer learning. Our results show that, compared to the SR, the DR gives rise to qualitatively different, reward-aware behaviour and quantitatively better performance in several settings.
Structure-Aware Spectral Sparsification via Uniform Edge Sampling
Spectral clustering is a fundamental method for graph partitioning, but its reliance on eigenvector computation limits scalability to massive graphs. Classical sparsification methods preserve spectral properties by sampling edges proportionally to their effective resistances, but require expensive preprocessing to estimate these resistances. We study whether uniform edge sampling--a simple, structure-agnostic strategy--can suffice for spectral clustering. Our main result shows that for graphs admitting a well-separated k-clustering, characterized by a large structure ratio Υ(k) = λk+1/ρG(k), uniform sampling preserves the spectral subspace used for clustering. Specifically, we prove that uniformly sampling O(γ2nlogn/ε2) edges, where γ is the Laplacian condition number, yields a sparsifier whose top (n k)dimensional eigenspace is approximately orthogonal to the cluster indicators.