variational family
Variational Inference with Mixtures of Isotropic Gaussians
Variational inference (VI) is a popular approach in Bayesian inference, that looks for the best approximation of the posterior distribution within a parametric family, minimizing a loss that is typically the (reverse) Kullback-Leibler (KL) divergence. In this paper, we focus on the following parametric family: mixtures of isotropic Gaussians (i.e., with diagonal covariance matrices proportional to the identity) and uniform weights. We develop a variational framework and provide efficient algorithms suited for this family. In contrast with mixtures of Gaussian with generic covariance matrices, this choice presents a balance between accurate approximations of multimodal Bayesian posteriors, while being memory and computationally efficient. Our algorithms implement gradient descent on the location of the mixture components (the modes of the Gaussians), and either (an entropic) Mirror or Bures descent on their variance parameters. We illustrate the performance of our algorithms on numerical experiments.
Nearly Dimension-Independent Convergence of Mean-Field Black-Box Variational Inference
We prove that, given a mean-field location-scale variational family, black-box variational inference (BBVI) with the reparametrization gradient converges at a rate that is nearly independent of any explicit dimension dependence. Specifically, for a d-dimensional strongly log-concave and log-smooth target, the number of iterations for BBVI with a sub-Gaussian family to obtain a solution ϵ-close to the global optimum has an explicit dimension dependence no larger than O(logd). This is a significant improvement over the O(d)dependence of full-rank locationscale families. For heavy-tailed families, we prove a weaker O(d2/k)dependence, where kis the number of finite moments of the family. Additionally, if the Hessian of the target log-density is constant, the complexity is free of any explicit dimension dependence. We also prove that our bound on the gradient variance, which is key to our result, cannot be improved using only spectral bounds on the Hessian of the target log-density.
Fisher meets Feynman: score-based variational inference with a product of experts
We introduce a highly expressive yet distinctly tractable family for black-box variational inference (BBVI). Each member of this family is a weighted product of experts (PoE), and each weighted expert in the product is proportional to a multivariate t-distribution. These products of experts can model distributions with skew, heavy tails, and multiple modes, but to use them for BBVI, we must be able to sample from their densities. We show how to do this by reformulating these products of experts as latent variable models with auxiliary Dirichlet random variables. These Dirichlet variables emerge from a Feynman identity, originally developed for loop integrals in quantum field theory, that expresses the product of multiple fractions (or in our case, t-distributions) as an integral over the simplex.
Variational predictive resampling
Battaglia, Laura, Cortinovis, Stefano, Holmes, Chris, Frazier, David T., Jewson, Jack
Bayesian inference provides principled uncertainty quantification, but accurate posterior sampling with MCMC can be computationally prohibitive for modern applications. Variational inference (VI) offers a scalable alternative and often yields accurate predictive distributions, but cheap variational families such as mean-field (MF) can produce over-concentrated approximations that miss posterior dependence. We propose variational predictive resampling (VPR), a scalable posterior sampling method that exploits VI's predictive strength within a predictive-resampling framework to better approximate the Bayesian posterior. Given a prior-likelihood pair, VPR repeatedly imputes future observations from the current variational predictive, updates the variational approximation after each imputation, and records the parameter value implied by the completed sample. We establish conditions under which the law of the parameter returned by VPR is well defined and show that its finite-horizon approximation converges to this limit. In a tractable Gaussian location model, we show that VPR with MF variational predictives converges to the exact Bayesian posterior, whereas the optimal MF-VI approximation retains a non-vanishing asymptotic gap. Experiments on linear regression, logistic regression, and hierarchical linear mixed-effects models demonstrate that VPR substantially improves posterior uncertainty quantification and recovers posterior dependence missed by MF-VI, while remaining computationally competitive with, and often more efficient than, MCMC.
Bayesian inference with sources of uncertainty: from confidence modelling to sparse estimation
Rosa, Rafael Mouallem, Arbel, Julyan, Nguyen, Hien Duy
We introduce a general framework that extends Bayesian inference by allowing the researcher to explicitly encode confidence in each source of uncertainty within the model. This mechanism provides a new handle for model design and regularisation control. Building on this framework, we develop a general approach for inducing sparsity in statistical models and illustrate its use in linear and logistic regression, as well as in Bayesian neural networks.
Challenges and Opportunities in High-dimensional Variational Inference
Current black-box variational inference (BBVI) methods require the user to make numerous design choices--such as the selection of variational objective and approximating family--yet there is little principled guidance on how to do so. We develop a conceptual framework and set of experimental tools to understand the effects of these choices, which we leverage to propose best practices for maximizing posterior approximation accuracy. Our approach is based on studying the pre-asymptotic tail behavior of the density ratios between the joint distribution and the variational approximation, then exploiting insights and tools from the importance sampling literature. Our framework and supporting experiments help to distinguish between the behavior of BBVI methods for approximating low-dimensional versus moderate-to-high-dimensional posteriors. In the latter case, we show that mass-covering variational objectives are difficult to optimize and do not improve accuracy, but flexible variational families can improve accuracy and the effectiveness of importance sampling--at the cost of additional optimization challenges. Therefore, for moderate-to-high-dimensional posteriors we recommend using the (mode-seeking) exclusive KL divergence since it is the easiest to optimize, and improving the variational family or using model parameter transformations to make the posterior and optimal variational approximation more similar. On the other hand, in low-dimensional settings, we show that heavy-tailed variational families and mass-covering divergences are effective and can increase the chances that the approximation can be improved by importance sampling.
BCDNets: Scalable Variational Approaches for Bayesian Causal Discovery
A structural equation model (SEM) is an effective framework to reason over causal relationships represented via a directed acyclic graph (DAG). Recent advances have enabled effective maximum-likelihood point estimation of DAGs from observational data. However, a point estimate may not accurately capture the uncertainty in inferring the underlying graph in practical scenarios, wherein the true DAG is non-identifiable and/or the observed dataset is limited. We propose Bayesian Causal Discovery Nets (BCD Nets), a variational inference framework for estimating a distribution over DAGs characterizing a linear-Gaussian SEM. Developing a full Bayesian posterior over DAGs is challenging due to the the discrete and combinatorial nature of graphs. We analyse key design choices for scalable VI over DAGs, such as 1) the parametrization of DAGs via an expressive variational family, 2) a continuous relaxation that enables low-variance stochastic optimization, and 3) suitable priors over the latent variables. We provide a series of experiments on real and synthetic data showing that BCDNets outperform maximum-likelihood methods on standard causal discovery metrics such as structural Hamming distance in low data regimes.
Even More Guarantees for Variational Inference in the Presence of Symmetries
Zellinger, Lena, Vergari, Antonio
When approximating an intractable density via variational inference (VI) the variational family is typically chosen as a simple parametric family that very likely does not contain the target. This raises the question: Under which conditions can we recover characteristics of the target despite misspecification? In this work, we extend previous results on robust VI with location-scale families under target symmetries. We derive sufficient conditions guaranteeing exact recovery of the mean when using the forward Kullback-Leibler divergence and $α$-divergences. We further show how and why optimization can fail to recover the target mean in the absence of our sufficient conditions, providing initial guidelines on the choice of the variational family and $α$-value.