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Justin Domke

Publications and source records attributed to Justin Domke.

At least 19 recordsLinked to original sources

Amortized Factor Inference Networks for Posterior Inference

Amortized inference promises fast test-time Bayesian inference, but existing methods are inherently tied to fixed models. Extending amortization to unseen models typically requires retraining or costly test-time finetuning. In this paper, we ask: is it possible to build a single inference network capable of generalizing across varying priors, likelihoods, and dimensionality? We introduce Amortized Factor Inference Networks (AFINs), a family of encode-merge-decode inference networks built on dimension-independent modules that map a model specification and its observations to the parameters of a variational posterior. Experimentally, a single trained AFIN achieves posterior accuracy comparable to NUTS and several variational inference methods, while requiring 2 to 4 orders of magnitude less test-time compute. Code is available at https://github.com/joohwanko/AFINs.

cs.LG

Model-Informed Flows for Bayesian Inference

Variational inference often struggles with the posterior geometry exhibited by complex hierarchical Bayesian models. Recent advances in flow-based variational families and Variationally Inferred Parameters (VIP) each address aspects of this challenge, but their formal relationship is unexplored. Here, we prove that the combination of VIP and a full-rank Gaussian can be represented exactly as a forward autoregressive flow augmented with a translation term and input from the model's prior. Guided by this theoretical insight, we introduce the Model-Informed Flow (MIF) architecture, which adds the necessary translation mechanism, prior information, and hierarchical ordering. Empirically, MIF delivers tighter posterior approximations and matches or exceeds state-of-the-art performance across a suite of hierarchical and non-hierarchical benchmarks.

cs.LG

Large Language Bayes

Many domain experts do not have the time or expertise to write formal Bayesian models. This paper takes an informal problem description as input, and combines a large language model and a probabilistic programming language to define a joint distribution over formal models, latent variables, and data. A posterior over latent variables follows by conditioning on observed data and integrating over formal models. This presents a challenging inference problem. We suggest an inference recipe that amounts to generating many formal models from the large language model, performing approximate inference on each, and then doing a weighted average. This is justified and analyzed as a combination of self-normalized importance sampling, MCMC, and importance-weighted variational inference. Experimentally, this produces sensible predictions from only data and an informal problem description, without the need to specify a formal model.

cs.LG

Disentangling impact of capacity, objective, batchsize, estimators, and step-size on flow VI

Normalizing flow-based variational inference (flow VI) is a promising approximate inference approach, but its performance remains inconsistent across studies. Numerous algorithmic choices influence flow VI's performance. We conduct a step-by-step analysis to disentangle the impact of some of the key factors: capacity, objectives, gradient estimators, number of gradient estimates (batchsize), and step-sizes. Each step examines one factor while neutralizing others using insights from the previous steps and/or using extensive parallel computation. To facilitate high-fidelity evaluation, we curate a benchmark of synthetic targets that represent common posterior pathologies and allow for exact sampling. We provide specific recommendations for different factors and propose a flow VI recipe that matches or surpasses leading turnkey Hamiltonian Monte Carlo (HMC) methods.

cs.LG

Hamiltonian Monte Carlo Inference of Marginalized Linear Mixed-Effects Models

Bayesian reasoning in linear mixed-effects models (LMMs) is challenging and often requires advanced sampling techniques like Markov chain Monte Carlo (MCMC). A common approach is to write the model in a probabilistic programming language and then sample via Hamiltonian Monte Carlo (HMC). However, there are many ways a user can transform a model that make inference more or less efficient. In particular, marginalizing some variables can greatly improve inference but is difficult for users to do manually. We develop an algorithm to easily marginalize random effects in LMMs. A naive approach introduces cubic time operations within an inference algorithm like HMC, but we reduce the running time to linear using fast linear algebra techniques. We show that marginalization is always beneficial when applicable and highlight improvements in various models, especially ones from cognitive sciences.

cs.LG

Understanding and mitigating difficulties in posterior predictive evaluation

Predictive posterior densities (PPDs) are of interest in approximate Bayesian inference. Typically, these are estimated by simple Monte Carlo (MC) averages using samples from the approximate posterior. We observe that the signal-to-noise ratio (SNR) of such estimators can be extremely low. An analysis for exact inference reveals SNR decays exponentially as there is an increase in (a) the mismatch between training and test data, (b) the dimensionality of the latent space, or (c) the size of the test data relative to the training data. Further analysis extends these results to approximate inference. To remedy the low SNR problem, we propose replacing simple MC sampling with importance sampling using a proposal distribution optimized at test time on a variational proxy for the SNR and demonstrate that this yields greatly improved estimates.

cs.LG

Simulation-based stacking

Simulation-based inference has been popular for amortized Bayesian computation. It is typical to have more than one posterior approximation, from different inference algorithms, different architectures, or simply the randomness of initialization and stochastic gradients. With a consistency guarantee, we present a general posterior stacking framework to make use of all available approximations. Our stacking method is able to combine densities, simulation draws, confidence intervals, and moments, and address the overall precision, calibration, coverage, and bias of the posterior approximation at the same time. We illustrate our method on several benchmark simulations and a challenging cosmological inference task.

stat.ME

Provable convergence guarantees for black-box variational inference

Black-box variational inference is widely used in situations where there is no proof that its stochastic optimization succeeds. We suggest this is due to a theoretical gap in existing stochastic optimization proofs: namely the challenge of gradient estimators with unusual noise bounds, and a composite non-smooth objective. For dense Gaussian variational families, we observe that existing gradient estimators based on reparameterization satisfy a quadratic noise bound and give novel convergence guarantees for proximal and projected stochastic gradient descent using this bound. This provides rigorous guarantees that methods similar to those used in practice converge on realistic inference problems.

cs.LG

Discriminative calibration: Check Bayesian computation from simulations and flexible classifier

To check the accuracy of Bayesian computations, it is common to use rank-based simulation-based calibration (SBC). However, SBC has drawbacks: The test statistic is somewhat ad-hoc, interactions are difficult to examine, multiple testing is a challenge, and the resulting p-value is not a divergence metric. We propose to replace the marginal rank test with a flexible classification approach that learns test statistics from data. This measure typically has a higher statistical power than the SBC rank test and returns an interpretable divergence measure of miscalibration, computed from classification accuracy. This approach can be used with different data generating processes to address likelihood-free inference or traditional inference methods like Markov chain Monte Carlo or variational inference. We illustrate an automated implementation using neural networks and statistically-inspired features, and validate the method with numerical and real data experiments.

stat.ML

Sample Average Approximation for Black-Box VI

We present a novel approach for black-box VI that bypasses the difficulties of stochastic gradient ascent, including the task of selecting step-sizes. Our approach involves using a sequence of sample average approximation (SAA) problems. SAA approximates the solution of stochastic optimization problems by transforming them into deterministic ones. We use quasi-Newton methods and line search to solve each deterministic optimization problem and present a heuristic policy to automate hyperparameter selection. Our experiments show that our method simplifies the VI problem and achieves faster performance than existing methods.

cs.LG

U-Statistics for Importance-Weighted Variational Inference

We propose the use of U-statistics to reduce variance for gradient estimation in importance-weighted variational inference. The key observation is that, given a base gradient estimator that requires $m > 1$ samples and a total of $n > m$ samples to be used for estimation, lower variance is achieved by averaging the base estimator on overlapping batches of size $m$ than disjoint batches, as currently done. We use classical U-statistic theory to analyze the variance reduction, and propose novel approximations with theoretical guarantees to ensure computational efficiency. We find empirically that U-statistic variance reduction can lead to modest to significant improvements in inference performance on a range of models, with little computational cost.

cs.LG

Joint control variate for faster black-box variational inference

Black-box variational inference performance is sometimes hindered by the use of gradient estimators with high variance. This variance comes from two sources of randomness: Data subsampling and Monte Carlo sampling. While existing control variates only address Monte Carlo noise, and incremental gradient methods typically only address data subsampling, we propose a new "joint" control variate that jointly reduces variance from both sources of noise. This significantly reduces gradient variance, leading to faster optimization in several applications.

cs.LG

Langevin Diffusion Variational Inference

Many methods that build powerful variational distributions based on unadjusted Langevin transitions exist. Most of these were developed using a wide range of different approaches and techniques. Unfortunately, the lack of a unified analysis and derivation makes developing new methods and reasoning about existing ones a challenging task. We address this giving a single analysis that unifies and generalizes these existing techniques. The main idea is to augment the target and variational by numerically simulating the underdamped Langevin diffusion process and its time reversal. The benefits of this approach are twofold: it provides a unified formulation for many existing methods, and it simplifies the development of new ones. In fact, using our formulation we propose a new method that combines the strengths of previously existing algorithms; it uses underdamped Langevin transitions and powerful augmentations parameterized by a score network. Our empirical evaluation shows that our proposed method consistently outperforms relevant baselines in a wide range of tasks.

cs.LG

Variational Inference with Locally Enhanced Bounds for Hierarchical Models

Hierarchical models represent a challenging setting for inference algorithms. MCMC methods struggle to scale to large models with many local variables and observations, and variational inference (VI) may fail to provide accurate approximations due to the use of simple variational families. Some variational methods (e.g. importance weighted VI) integrate Monte Carlo methods to give better accuracy, but these tend to be unsuitable for hierarchical models, as they do not allow for subsampling and their performance tends to degrade for high dimensional models. We propose a new family of variational bounds for hierarchical models, based on the application of tightening methods (e.g. importance weighting) separately for each group of local random variables. We show that our approach naturally allows the use of subsampling to get unbiased gradients, and that it fully leverages the power of methods that build tighter lower bounds by applying them independently in lower dimensional spaces, leading to better results and more accurate posterior approximations than relevant baselines.

cs.LG

Amortized Variational Inference for Simple Hierarchical Models

It is difficult to use subsampling with variational inference in hierarchical models since the number of local latent variables scales with the dataset. Thus, inference in hierarchical models remains a challenge at large scale. It is helpful to use a variational family with structure matching the posterior, but optimization is still slow due to the huge number of local distributions. Instead, this paper suggests an amortized approach where shared parameters simultaneously represent all local distributions. This approach is similarly accurate as using a given joint distribution (e.g., a full-rank Gaussian) but is feasible on datasets that are several orders of magnitude larger. It is also dramatically faster than using a structured variational distribution.

cs.LG

Variational Marginal Particle Filters

Variational inference for state space models (SSMs) is known to be hard in general. Recent works focus on deriving variational objectives for SSMs from unbiased sequential Monte Carlo estimators. We reveal that the marginal particle filter is obtained from sequential Monte Carlo by applying Rao-Blackwellization operations, which sacrifices the trajectory information for reduced variance and differentiability. We propose the variational marginal particle filter (VMPF), which is a differentiable and reparameterizable variational filtering objective for SSMs based on an unbiased estimator. We find that VMPF with biased gradients gives tighter bounds than previous objectives, and the unbiased reparameterization gradients are sometimes beneficial.

stat.ML

MCMC Variational Inference via Uncorrected Hamiltonian Annealing

Given an unnormalized target distribution we want to obtain approximate samples from it and a tight lower bound on its (log) normalization constant log Z. Annealed Importance Sampling (AIS) with Hamiltonian MCMC is a powerful method that can be used to do this. Its main drawback is that it uses non-differentiable transition kernels, which makes tuning its many parameters hard. We propose a framework to use an AIS-like procedure with Uncorrected Hamiltonian MCMC, called Uncorrected Hamiltonian Annealing. Our method leads to tight and differentiable lower bounds on log Z. We show empirically that our method yields better performances than other competing approaches, and that the ability to tune its parameters using reparameterization gradients may lead to large performance improvements.

cs.LG

Empirical Evaluation of Biased Methods for Alpha Divergence Minimization

In this paper we empirically evaluate biased methods for alpha-divergence minimization. In particular, we focus on how the bias affects the final solutions found, and how this depends on the dimensionality of the problem. We find that (i) solutions returned by these methods appear to be strongly biased towards minimizers of the traditional "exclusive" KL-divergence, KL(q||p), and (ii) in high dimensions, an impractically large amount of computation is needed to mitigate this bias and obtain solutions that actually minimize the alpha-divergence of interest.

cs.LG