Recently, there has been a growing interest in efficient numerical algorithms based on tensor networks and low-rank techniques to approximate high-dimensional functions and solutions to high-dimensional PDEs. In this paper, we propose a new tensor rank reduction method based on coordinate transformations that can greatly increase the efficiency of high-dimensional tensor approximation algorithms. The idea is simple: given a multivariate function, determine a coordinate transformation so that the function in the new coordinate system has smaller tensor rank. We restrict our analysis to linear coordinate transformations, which gives rise to a new class of functions that we refer to as tensor ridge functions. Leveraging Riemannian gradient descent on matrix manifolds we develop an algorithm that determines a quasi-optimal linear coordinate transformation for tensor rank reduction.The results we present for rank reduction via linear coordinate transformations open the possibility for generalizations to larger classes of nonlinear transformations. Numerical applications are presented and discussed for linear and nonlinear PDEs.
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In this paper we demonstrate how sub-Riemannian geometry can be used for manifold learning and surface reconstruction by combining local linear approximations of a point cloud to obtain lower dimensional bundles. Local approximations obtained by local PCAs are collected into a rank $k$ tangent subbundle on $\mathbb{R}^d$, $k<d$, which we call a principal subbundle. This determines a sub-Riemannian metric on $\mathbb{R}^d$. We show that sub-Riemannian geodesics with respect to this metric can successfully be applied to a number of important problems, such as: explicit construction of an approximating submanifold $M$, construction of a representation of the point-cloud in $\mathbb{R}^k$, and computation of distances between observations, taking the learned geometry into account. The reconstruction is guaranteed to equal the true submanifold in the limit case where tangent spaces are estimated exactly. Via simulations, we show that the framework is robust when applied to noisy data. Furthermore, the framework generalizes to observations on an a priori known Riemannian manifold.
Many stochastic processes in the physical and biological sciences can be modelled using Brownian dynamics with multiplicative noise. However, numerical integrators for these processes can lose accuracy or even fail to converge when the diffusion term is configuration-dependent. One remedy is to construct a transform to a constant-diffusion process and sample the transformed process instead. In this work, we explain how coordinate-based and time-rescaling-based transforms can be used either individually or in combination to map a general class of variable-diffusion Brownian motion processes into constant-diffusion ones. The transforms are invertible, thus allowing recovery of the original dynamics. We motivate our methodology using examples in one dimension before then considering multivariate diffusion processes. We illustrate the benefits of the transforms through numerical simulations, demonstrating how the right combination of integrator and transform can improve computational efficiency and the order of convergence to the invariant distribution. Notably, the transforms that we derive are applicable to a class of multibody, anisotropic Stokes-Einstein diffusion that has applications in biophysical modelling.
Tractography traces the peak directions extracted from fiber orientation distribution (FOD) suffering from ambiguous spatial correspondences between diffusion directions and fiber geometry, which is prone to producing erroneous tracks while missing true positive connections. The peaks-based tractography methods 'locally' reconstructed streamlines in 'single to single' manner, thus lacking of global information about the trend of the whole fiber bundle. In this work, we propose a novel tractography method based on a bundle-specific tractogram distribution function by using a higher-order streamline differential equation, which reconstructs the streamline bundles in 'cluster to cluster' manner. A unified framework for any higher-order streamline differential equation is presented to describe the fiber bundles with disjoint streamlines defined based on the diffusion tensor vector field. At the global level, the tractography process is simplified as the estimation of bundle-specific tractogram distribution (BTD) coefficients by minimizing the energy optimization model, and is used to characterize the relations between BTD and diffusion tensor vector under the prior guidance by introducing the tractogram bundle information to provide anatomic priors. Experiments are performed on simulated Hough, Sine, Circle data, ISMRM 2015 Tractography Challenge data, FiberCup data, and in vivo data from the Human Connectome Project (HCP) data for qualitative and quantitative evaluation. The results demonstrate that our approach can reconstruct the complex global fiber bundles directly. BTD reduces the error deviation and accumulation at the local level and shows better results in reconstructing long-range, twisting, and large fanning tracts.
Despite their simple intuition, convolutions are more tedious to analyze than dense layers, which complicates the generalization of theoretical and algorithmic ideas. We provide a new perspective onto convolutions through tensor networks (TNs) which allow reasoning about the underlying tensor multiplications by drawing diagrams, and manipulating them to perform function transformations, sub-tensor access, and fusion. We demonstrate this expressive power by deriving the diagrams of various autodiff operations and popular approximations of second-order information with full hyper-parameter support, batching, channel groups, and generalization to arbitrary convolution dimensions. Further, we provide convolution-specific transformations based on the connectivity pattern which allow to re-wire and simplify diagrams before evaluation. Finally, we probe computational performance, relying on established machinery for efficient TN contraction. Our TN implementation speeds up a recently-proposed KFAC variant up to 4.5x and enables new hardware-efficient tensor dropout for approximate backpropagation.
Maximum weight independent set (MWIS) admits a $\frac1k$-approximation in inductively $k$-independent graphs and a $\frac{1}{2k}$-approximation in $k$-perfectly orientable graphs. These are a a parameterized class of graphs that generalize $k$-degenerate graphs, chordal graphs, and intersection graphs of various geometric shapes such as intervals, pseudo-disks, and several others. We consider a generalization of MWIS to a submodular objective. Given a graph $G=(V,E)$ and a non-negative submodular function $f: 2^V \rightarrow \mathbb{R}_+$, the goal is to approximately solve $\max_{S \in \mathcal{I}_G} f(S)$ where $\mathcal{I}_G$ is the set of independent sets of $G$. We obtain an $\Omega(\frac1k)$-approximation for this problem in the two mentioned graph classes. The first approach is via the multilinear relaxation framework and a simple contention resolution scheme, and this results in a randomized algorithm with approximation ratio at least $\frac{1}{e(k+1)}$. This approach also yields parallel (or low-adaptivity) approximations. Motivated by the goal of designing efficient and deterministic algorithms, we describe two other algorithms for inductively $k$-independent graphs that are inspired by work on streaming algorithms: a preemptive greedy algorithm and a primal-dual algorithm. In addition to being simpler and faster, these algorithms, in the monotone submodular case, yield the first deterministic constant factor approximations for various special cases that have been previously considered such as intersection graphs of intervals, disks and pseudo-disks.
Despite their remarkable success in approximating a wide range of operators defined by PDEs, existing neural operators (NOs) do not necessarily perform well for all physics problems. We focus here on high-frequency waves to highlight possible shortcomings. To resolve these, we propose a subfamily of NOs enabling an enhanced empirical approximation of the nonlinear operator mapping wave speed to solution, or boundary values for the Helmholtz equation on a bounded domain. The latter operator is commonly referred to as the ''forward'' operator in the study of inverse problems. Our methodology draws inspiration from transformers and techniques such as stochastic depth. Our experiments reveal certain surprises in the generalization and the relevance of introducing stochastic depth. Our NOs show superior performance as compared with standard NOs, not only for testing within the training distribution but also for out-of-distribution scenarios. To delve into this observation, we offer an in-depth analysis of the Rademacher complexity associated with our modified models and prove an upper bound tied to their stochastic depth that existing NOs do not satisfy. Furthermore, we obtain a novel out-of-distribution risk bound tailored to Gaussian measures on Banach spaces, again relating stochastic depth with the bound. We conclude by proposing a hypernetwork version of the subfamily of NOs as a surrogate model for the mentioned forward operator.
The multivariate adaptive regression spline (MARS) is one of the popular estimation methods for nonparametric multivariate regressions. However, as MARS is based on marginal splines, to incorporate interactions of covariates, products of the marginal splines must be used, which leads to an unmanageable number of basis functions when the order of interaction is high and results in low estimation efficiency. In this paper, we improve the performance of MARS by using linear combinations of the covariates which achieve sufficient dimension reduction. The special basis functions of MARS facilitate calculation of gradients of the regression function, and estimation of the linear combinations is obtained via eigen-analysis of the outer-product of the gradients. Under some technical conditions, the asymptotic theory is established for the proposed estimation method. Numerical studies including both simulation and empirical applications show its effectiveness in dimension reduction and improvement over MARS and other commonly-used nonparametric methods in regression estimation and prediction.
We propose a novel framework for analyzing the dynamics of distribution shift in real-world systems that captures the feedback loop between learning algorithms and the distributions on which they are deployed. Prior work largely models feedback-induced distribution shift as adversarial or via an overly simplistic distribution-shift structure. In contrast, we propose a coupled partial differential equation model that captures fine-grained changes in the distribution over time by accounting for complex dynamics that arise due to strategic responses to algorithmic decision-making, non-local endogenous population interactions, and other exogenous sources of distribution shift. We consider two common settings in machine learning: cooperative settings with information asymmetries, and competitive settings where a learner faces strategic users. For both of these settings, when the algorithm retrains via gradient descent, we prove asymptotic convergence of the retraining procedure to a steady-state, both in finite and in infinite dimensions, obtaining explicit rates in terms of the model parameters. To do so we derive new results on the convergence of coupled PDEs that extends what is known on multi-species systems. Empirically, we show that our approach captures well-documented forms of distribution shifts like polarization and disparate impacts that simpler models cannot capture.
Effective String Theory (EST) represents a powerful non-perturbative approach to describe confinement in Yang-Mills theory that models the confining flux tube as a thin vibrating string. EST calculations are usually performed using the zeta-function regularization: however there are situations (for instance the study of the shape of the flux tube or of the higher order corrections beyond the Nambu-Goto EST) which involve observables that are too complex to be addressed in this way. In this paper we propose a numerical approach based on recent advances in machine learning methods to circumvent this problem. Using as a laboratory the Nambu-Goto string, we show that by using a new class of deep generative models called Continuous Normalizing Flows it is possible to obtain reliable numerical estimates of EST predictions.
Tensor ring (TR) decomposition is an efficient approach to discover the hidden low-rank patterns for higher-order tensors, and streaming tensors are becoming highly prevalent in real-world applications. In this paper, we investigate how to track TR decompositions of streaming tensors. An efficient algorithm is first proposed. Then, based on this algorithm and randomized techniques, we present a randomized streaming TR decomposition. The proposed algorithms make full use of the structure of TR decomposition, and the randomized version can allow any sketching type. Theoretical results on sketch size are provided. In addition, the complexity analyses for the obtained algorithms are also given. We compare our proposals with the existing batch methods using both real and synthetic data. Numerical results show that they have better performance in computing time with maintaining similar accuracy.
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