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In the setting of functional data analysis, we derive optimal rates of convergence in the supremum norm for estimating the H\"older-smooth mean function of a stochastic processes which is repeatedly and discretely observed at fixed, multivariate, synchronous design points and with additional errors. Similarly to the rates in $L_2$ obtained in Cai and Yuan (2011), for sparse design a discretization term dominates, while in the dense case the $\sqrt n$ rate can be achieved as if the $n$ processes were continuously observed without errors. However, our analysis differs in several respects from Cai and Yuan (2011). First, we do not assume that the paths of the processes are as smooth as the mean, but still obtain the $\sqrt n$ rate of convergence without additional logarithmic factors in the dense setting. Second, we show that in the supremum norm, there is an intermediate regime between the sparse and dense cases dominated by the contribution of the observation errors. Third, and in contrast to the analysis in $L_2$, interpolation estimators turn out to be sub-optimal in $L_\infty$ in the dense setting, which explains their poor empirical performance. We also obtain a central limit theorem in the supremum norm and discuss the selection of the bandwidth. Simulations and real data applications illustrate the results.

Neural network approaches for meta-learning distributions over functions have desirable properties such as increased flexibility and a reduced complexity of inference. Building on the successes of denoising diffusion models for generative modelling, we propose Neural Diffusion Processes (NDPs), a novel approach that learns to sample from a rich distribution over functions through its finite marginals. By introducing a custom attention block we are able to incorporate properties of stochastic processes, such as exchangeability, directly into the NDP's architecture. We empirically show that NDPs can capture functional distributions close to the true Bayesian posterior, demonstrating that they can successfully emulate the behaviour of Gaussian processes and surpass the performance of neural processes. NDPs enable a variety of downstream tasks, including regression, implicit hyperparameter marginalisation, non-Gaussian posterior prediction and global optimisation.

Prompt-tuning is an emerging strategy to adapt large language models (LLM) to downstream tasks by learning a (soft-)prompt parameter from data. Despite its success in LLMs, there is limited theoretical understanding of the power of prompt-tuning and the role of the attention mechanism in prompting. In this work, we explore prompt-tuning for one-layer attention architectures and study contextual mixture-models where each input token belongs to a context-relevant or -irrelevant set. We isolate the role of prompt-tuning through a self-contained prompt-attention model. Our contributions are as follows: (1) We show that softmax-prompt-attention is provably more expressive than softmax-self-attention and linear-prompt-attention under our contextual data model. (2) We analyze the initial trajectory of gradient descent and show that it learns the prompt and prediction head with near-optimal sample complexity and demonstrate how prompt can provably attend to sparse context-relevant tokens. (3) Assuming a known prompt but an unknown prediction head, we characterize the exact finite sample performance of prompt-attention which reveals the fundamental performance limits and the precise benefit of the context information. We also provide experiments that verify our theoretical insights on real datasets and demonstrate how prompt-tuning enables the model to attend to context-relevant information.

Large-scale administrative or observational datasets are increasingly used to inform decision making. While this effort aims to ground policy in real-world evidence, challenges have arise as that selection bias and other forms of distribution shift often plague observational data. Previous attempts to provide robust inferences have given guarantees depending on a user-specified amount of possible distribution shift (e.g., the maximum KL divergence between the observed and target distributions). However, decision makers will often have additional knowledge about the target distribution which constrains the kind of shifts which are possible. To leverage such information, we proposed a framework that enables statistical inference in the presence of distribution shifts which obey user-specified constraints in the form of functions whose expectation is known under the target distribution. The output is high-probability bounds on the value an estimand takes on the target distribution. Hence, our method leverages domain knowledge in order to partially identify a wide class of estimands. We analyze the computational and statistical properties of methods to estimate these bounds, and show that our method can produce informative bounds on a variety of simulated and semisynthetic tasks.

In this paper, we study sampling from a posterior derived from a neural network. We propose a new probabilistic model consisting of adding noise at every pre- and post-activation in the network, arguing that the resulting posterior can be sampled using an efficient Gibbs sampler. The Gibbs sampler attains similar performances as the state-of-the-art Monte Carlo Markov chain methods, such as the Hamiltonian Monte Carlo or the Metropolis adjusted Langevin algorithm, both on real and synthetic data. By framing our analysis in the teacher-student setting, we introduce a thermalization criterion that allows us to detect when an algorithm, when run on data with synthetic labels, fails to sample from the posterior. The criterion is based on the fact that in the teacher-student setting we can initialize an algorithm directly at equilibrium.

We consider the block coordinate descent methods of Gauss-Seidel type with proximal regularization (BCD-PR), which is a classical method of minimizing general nonconvex objectives under constraints that has a wide range of practical applications. We theoretically establish the worst-case complexity bound for this algorithm. Namely, we show that for general nonconvex smooth objectives with block-wise constraints, the classical BCD-PR algorithm converges to an epsilon-stationary point within O(1/epsilon) iterations. Under a mild condition, this result still holds even if the algorithm is executed inexactly in each step. As an application, we propose a provable and efficient algorithm for `Wasserstein CP-dictionary learning', which seeks a set of elementary probability distributions that can well-approximate a given set of d-dimensional joint probability distributions. Our algorithm is a version of BCD-PR that operates in the dual space, where the primal problem is regularized both entropically and proximally.

In this article we develop a high order accurate method to solve the incompressible boundary layer equations in a provably stable manner.~We first derive continuous energy estimates,~and then proceed to the discrete setting.~We formulate the discrete approximation using high-order finite difference methods on summation-by-parts form and implement the boundary conditions weakly using the simultaneous approximation term method.~By applying the discrete energy method and imitating the continuous analysis,~the discrete estimate that resembles the continuous counterpart is obtained proving stability.~We also show that these newly derived boundary conditions removes the singularities associated with the null-space of the nonlinear discrete spatial operator.~Numerical experiments that verifies the high-order accuracy of the scheme and coincides with the theoretical results are presented.~The numerical results are compared with the well-known Blasius similarity solution as well as that resulting from the solution of the incompressible Navier Stokes equations.

Diffusion processes are a class of stochastic differential equations (SDEs) providing a rich family of expressive models that arise naturally in dynamic modelling tasks. Probabilistic inference and learning under generative models with latent processes endowed with a non-linear diffusion process prior are intractable problems. We build upon work within variational inference approximating the posterior process as a linear diffusion process, point out pathologies in the approach, and propose an alternative parameterization of the Gaussian variational process using a continuous exponential family description. This allows us to trade a slow inference algorithm with fixed-point iterations for a fast algorithm for convex optimization akin to natural gradient descent, which also provides a better objective for the learning of model parameters.

Noise plagues many numerical datasets, where the recorded values in the data may fail to match the true underlying values due to reasons including: erroneous sensors, data entry/processing mistakes, or imperfect human estimates. Here we consider estimating which data values are incorrect along a numerical column. We present a model-agnostic approach that can utilize any regressor (i.e. statistical or machine learning model) which was fit to predict values in this column based on the other variables in the dataset. By accounting for various uncertainties, our approach distinguishes between genuine anomalies and natural data fluctuations, conditioned on the available information in the dataset. We establish theoretical guarantees for our method and show that other approaches like conformal inference struggle to detect errors. We also contribute a new error detection benchmark involving 5 regression datasets with real-world numerical errors (for which the true values are also known). In this benchmark and additional simulation studies, our method identifies incorrect values with better precision/recall than other approaches.

Parameter inference, i.e. inferring the posterior distribution of the parameters of a statistical model given some data, is a central problem to many scientific disciplines. Generative models can be used as an alternative to Markov Chain Monte Carlo methods for conducting posterior inference, both in likelihood-based and simulation-based problems. However, assessing the accuracy of posteriors encoded in generative models is not straightforward. In this paper, we introduce `Tests of Accuracy with Random Points' (TARP) coverage testing as a method to estimate coverage probabilities of generative posterior estimators. Our method differs from previously-existing coverage-based methods, which require posterior evaluations. We prove that our approach is necessary and sufficient to show that a posterior estimator is accurate. We demonstrate the method on a variety of synthetic examples, and show that TARP can be used to test the results of posterior inference analyses in high-dimensional spaces. We also show that our method can detect inaccurate inferences in cases where existing methods fail.