Gaussian Process Bandit Optimization of the Thermodynamic Variational Objective

Achieving the full promise of the Thermodynamic Variational Objective (TVO), a recently proposed variational lower bound on the log evidence involving a one-dimensional Riemann integral approximation, requires choosing a "schedule" of sorted discretization points. This paper introduces a bespoke Gaussian process bandit optimization method for automatically choosing these points. Our approach not only automates their one-time selection, but also dynamically adapts their positions over the course of optimization, leading to improved model learning and inference. We provide theoretical guarantees that our bandit optimization converges to the regret-minimizing choice of integration points. Empirical validation of our algorithm is provided in terms of improved learning and inference in Variational Autoencoders and Sigmoid Belief Networks.

Gaussian Process Bandit Optimization of theThermodynamic Variational Objective

Achieving the full promise of the Thermodynamic Variational Objective (TVO),a recently proposed variational lower bound on the log evidence involving a one-dimensional Riemann integral approximation, requires choosing a "schedule" ofsorted discretization points. This paper introduces a bespoke Gaussian processbandit optimization method for automatically choosing these points. Our approach not only automates their one-time selection, but also dynamically adaptstheir positions over the course of optimization, leading to improved model learning and inference. We provide theoretical guarantees that our bandit optimizationconverges to the regret-minimizing choice of integration points. Empirical validation of our algorithm is provided in terms of improved learning and inference inVariational Autoencoders and Sigmoid Belief Networks.

All in the Exponential Family: Bregman Duality in Thermodynamic Variational Inference

The recently proposed Thermodynamic Variational Objective (TVO) leverages thermodynamic integration to provide a family of variational inference objectives, which both tighten and generalize the ubiquitous Evidence Lower Bound (ELBO). However, the tightness of TVO bounds was not previously known, an expensive grid search was used to choose a "schedule" of intermediate distributions, and model learning suffered with ostensibly tighter bounds. In this work, we propose an exponential family interpretation of the geometric mixture curve underlying the TVO and various path sampling methods, which allows us to characterize the gap in TVO likelihood bounds as a sum of KL divergences. We propose to choose intermediate distributions using equal spacing in the moment parameters of our exponential family, which matches grid search performance and allows the schedule to adaptively update over the course of training. Finally, we derive a doubly reparameterized gradient estimator which improves model learning and allows the TVO to benefit from more refined bounds. To further contextualize our contributions, we provide a unified framework for understanding thermodynamic integration and the TVO using Taylor series remainders.

Discovery and Separation of Features for Invariant Representation Learning

Supervised machine learning models often associate irrelevant nuisance factors with the prediction target, which hurts generalization. We propose a framework for training robust neural networks that induces invariance to nuisances through learning to discover and separate predictive and nuisance factors of data. We present an information theoretic formulation of our approach, from which we derive training objectives and its connections with previous methods. Empirical results on a wide array of datasets show that the proposed framework achieves state-of-the-art performance, without requiring nuisance annotations during training.

Exact Rate-Distortion in Autoencoders via Echo Noise

Compression is at the heart of effective representation learning. However, lossy compression is typically achieved through simple parametric models like Gaussian noise to preserve analytic tractability, and the limitations this imposes on learning are largely unexplored. Further, the Gaussian prior assumptions in models such as variational autoencoders (VAEs) provide only an upper bound on the compression rate in general. We introduce a new noise channel, Echo noise, that admits a simple, exact expression for mutual information for arbitrary input distributions. The noise is constructed in a data-driven fashion that does not require restrictive distributional assumptions. With its complex encoding mechanism and exact rate regularization, Echo leads to improved bounds on log-likelihood and dominates $\beta$-VAEs across the achievable range of rate-distortion trade-offs. Further, we show that Echo noise can outperform state-of-the-art flow methods without the need to train complex distributional transformations

Invariant Representations without Adversarial Training

Representations of data that are invariant to changes in specified factors are useful for a wide range of problems: removing potential biases in prediction problems, controlling the effects of covariates, and disentangling meaningful factors of variation. Unfortunately, learning representations that exhibit invariance to arbitrary nuisance factors yet remain useful for other tasks is challenging. Existing approaches cast the trade-off between task performance and invariance in an adversarial way, using an iterative minimax optimization. We show that adversarial training is unnecessary and sometimes counter-productive; we instead cast invariant representation learning as a single information-theoretic objective that can be directly optimized. We demonstrate that this approach matches or exceeds performance of state-of-the-art adversarial approaches for learning fair representations and for generative modeling with controllable transformations.

Auto-Encoding Total Correlation Explanation

Advances in unsupervised learning enable reconstruction and generation of samples from complex distributions, but this success is marred by the inscrutability of the representations learned. We propose an information-theoretic approach to characterizing disentanglement and dependence in representation learning using multivariate mutual information, also called total correlation. The principle of total Cor-relation Ex-planation (CorEx) has motivated successful unsupervised learning applications across a variety of domains, but under some restrictive assumptions. Here we relax those restrictions by introducing a flexible variational lower bound to CorEx. Surprisingly, we find that this lower bound is equivalent to the one in variational autoencoders (VAE) under certain conditions. This information-theoretic view of VAE deepens our understanding of hierarchical VAE and motivates a new algorithm, AnchorVAE, that makes latent codes more interpretable through information maximization and enables generation of richer and more realistic samples.

Disentangled Representations via Synergy Minimization

Scientists often seek simplified representations of complex systems to facilitate prediction and understanding. If the factors comprising a representation allow us to make accurate predictions about our system, but obscuring any subset of the factors destroys our ability to make predictions, we say that the representation exhibits informational synergy. We argue that synergy is an undesirable feature in learned representations and that explicitly minimizing synergy can help disentangle the true factors of variation underlying data. We explore different ways of quantifying synergy, deriving new closed-form expressions in some cases, and then show how to modify learning to produce representations that are minimally synergistic. We introduce a benchmark task to disentangle separate characters from images of words. We demonstrate that Minimally Synergistic (MinSyn) representations correctly disentangle characters while methods relying on statistical independence fail.