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 manifold hypothesis



An approach to Fisher-Rao metric for infinite dimensional non-parametric information geometry

Cheng, Bing, Tong, Howell

arXiv.org Machine Learning

Being infinite dimensional, non-parametric information geometry has long faced an "intractability barrier" due to the fact that the Fisher-Rao metric is now a functional incurring difficulties in defining its inverse. This paper introduces a novel framework to resolve the intractability with an Orthogonal Decomposition of the Tangent Space ($T_fM = S \oplus S^{\perp}$), where $S$ represents an observable covariate subspace. Through the decomposition, we derive the Covariate Fisher Information Matrix (cFIM), denoted as ${\bf G}_f$, which is a finite-dimensional and computable representative of information extractable from the manifold's geometry. Significantly, by proving the Trace Theorem: $H_G(f) = \text{Tr}({\bf G}_f)$, we establish a rigorous foundation for the G-entropy previously introduced by us, thereby identifying it as a fundamental geometric invariant representing the total explainable statistical information captured by the probability distribution associated with a model. Furthermore, we establish a link between ${\bf G}_f$ and the second derivative (i.e. the curvature) of the KL-divergence, leading to the notion of Covariate Cramér-Rao Lower Bound(CRLB). We demonstrate that ${\bf G}_f$ is congruent to the Efficient Fisher Information Matrix, thereby providing fundamental limits of variance for semi-parametric estimators. Finally, we apply our geometric framework to the Manifold Hypothesis, lifting the latter from a heuristic assumption into a testable condition of rank-deficiency within the cFIM. By defining the Information Capture Ratio, we provide a rigorous method for estimating intrinsic dimensionality in high-dimensional data. In short, our work bridges the gap between abstract information geometry and the demand of explainable AI, by providing a tractable path for assessing the statistical coverage and the efficiency of non-parametric models.




Quantum-inspired Benchmark for Estimating Intrinsic Dimension

Das, Aritra, Iosue, Joseph T., Albert, Victor V.

arXiv.org Artificial Intelligence

Machine learning models can generalize well on real-world datasets. According to the manifold hypothesis, this is possible because datasets lie on a latent manifold with small intrinsic dimension (ID). There exist many methods for ID estimation (IDE), but their estimates vary substantially. This warrants benchmarking IDE methods on manifolds that are more complex than those in existing benchmarks. We propose a Quantum-Inspired Intrinsic-dimension Estimation (QuIIEst) benchmark consisting of infinite families of topologically non-trivial manifolds with known ID. Our benchmark stems from a quantum-optical method of embedding arbitrary homogeneous spaces while allowing for curvature modification and additive noise. The IDE methods tested were generally less accurate on QuIIEst manifolds than on existing benchmarks under identical resource allocation. We also observe minimal performance degradation with increasingly non-uniform curvature, underscoring the benchmark's inherent difficulty. As a result of independent interest, we perform IDE on the fractal Hofstadter's butterfly and identify which methods are capable of extracting the effective dimension of a space that is not a manifold.


Diffusion Models and the Manifold Hypothesis: Log-Domain Smoothing is Geometry Adaptive

Farghly, Tyler, Potaptchik, Peter, Howard, Samuel, Deligiannidis, George, Pidstrigach, Jakiw

arXiv.org Machine Learning

Diffusion models have achieved state-of-the-art performance, demonstrating remarkable generalisation capabilities across diverse domains. However, the mechanisms underpinning these strong capabilities remain only partially understood. A leading conjecture, based on the manifold hypothesis, attributes this success to their ability to adapt to low-dimensional geometric structure within the data. This work provides evidence for this conjecture, focusing on how such phenomena could result from the formulation of the learning problem through score matching. We inspect the role of implicit regularisation by investigating the effect of smoothing minimisers of the empirical score matching objective. Our theoretical and empirical results confirm that smoothing the score function -- or equivalently, smoothing in the log-density domain -- produces smoothing tangential to the data manifold. In addition, we show that the manifold along which the diffusion model generalises can be controlled by choosing an appropriate smoothing.


MAD: Manifold Attracted Diffusion

Elbrächter, Dennis, Alberti, Giovanni S., Santacesaria, Matteo

arXiv.org Machine Learning

Score-based diffusion models are a highly effective method for generating samples from a distribution of images. We consider scenarios where the training data comes from a noisy version of the target distribution, and present an efficiently implementable modification of the inference procedure to generate noiseless samples. Our approach is motivated by the manifold hypothesis, according to which meaningful data is concentrated around some low-dimensional manifold of a high-dimensional ambient space. The central idea is that noise manifests as low magnitude variation in off-manifold directions in contrast to the relevant variation of the desired distribution which is mostly confined to on-manifold directions. We introduce the notion of an extended score and show that, in a simplified setting, it can be used to reduce small variations to zero, while leaving large variations mostly unchanged. We describe how its approximation can be computed efficiently from an approximation to the standard score and demonstrate its efficacy on toy problems, synthetic data, and real data.



Exploring the Stratified Space Structure of an RL Game with the Volume Growth Transform

Curry, Justin, Lagasse, Brennan, Lam, Ngoc B., Cox, Gregory, Rosenbluth, David, Speranzon, Alberto

arXiv.org Artificial Intelligence

In this work, we explore the structure of the embedding space of a transformer model trained for playing a particular reinforcement learning (RL) game. Specifically, we investigate how a transformer-based Proximal Policy Optimization (PPO) model embeds visual inputs in a simple environment where an agent must collect "coins" while avoiding dynamic obstacles consisting of "spotlights. " By adapting Robinson et al. 's [15] study of the volume growth transform for LLMs to the RL setting, we find that the token embedding space for our visual coin collecting game is also not a manifold, and is better modeled as a stratified space, where local dimension can vary from point to point. We further strengthen Robinson's method by proving that fairly general volume growth curves can be realized by stratified spaces. Finally, we carry out an analysis that suggests that as an RL agent acts, its latent representation alternates between periods of low local dimension, while following a fixed sub-strategy, and bursts of high local dimension, where the agent achieves a sub-goal (e.g., collecting an object) or where the environmental complexity increases (e.g., more obstacles appear). Consequently, our work suggests that the distribution of dimensions in a stratified latent space may provide a new geometric indicator of complexity for RL games. 1


Graph Semi-Supervised Learning for Point Classification on Data Manifolds

Netto, Caio F. Deberaldini, Wang, Zhiyang, Ruiz, Luana

arXiv.org Machine Learning

We propose a graph semi-supervised learning framework for classification tasks on data manifolds. Motivated by the manifold hypothesis, we model data as points sampled from a low-dimensional manifold $\mathcal{M} \subset \mathbb{R}^F$. The manifold is approximated in an unsupervised manner using a variational autoencoder (VAE), where the trained encoder maps data to embeddings that represent their coordinates in $\mathbb{R}^F$. A geometric graph is constructed with Gaussian-weighted edges inversely proportional to distances in the embedding space, transforming the point classification problem into a semi-supervised node classification task on the graph. This task is solved using a graph neural network (GNN). Our main contribution is a theoretical analysis of the statistical generalization properties of this data-to-manifold-to-graph pipeline. We show that, under uniform sampling from $\mathcal{M}$, the generalization gap of the semi-supervised task diminishes with increasing graph size, up to the GNN training error. Leveraging a training procedure which resamples a slightly larger graph at regular intervals during training, we then show that the generalization gap can be reduced even further, vanishing asymptotically. Finally, we validate our findings with numerical experiments on image classification benchmarks, demonstrating the empirical effectiveness of our approach.