Density estimation using Real NVP

Unsupervised learning of probabilistic models is a central yet challenging problem in machine learning. Specifically, designing models with tractable learning, sampling, inference and evaluation is crucial in solving this task. We extend the space of such models using real-valued non-volume preserving (real NVP) transformations, a set of powerful invertible and learnable transformations, resulting in an unsupervised learning algorithm with exact log-likelihood computation, exact sampling, exact inference of latent variables, and an interpretable latent space. We demonstrate its ability to model natural images on four datasets through sampling, log-likelihood evaluation and latent variable manipulations.

Improved generator objectives for GANs

We present a framework to understand GAN training as alternating density ratio estimation and approximate divergence minimization. This provides an interpretation for the mismatched GAN generator and discriminator objectives often used in practice, and explains the problem of poor sample diversity. We also derive a family of generator objectives that target arbitrary $f$-divergences without minimizing a lower bound, and use them to train generative image models that target either improved sample quality or greater sample diversity.

Survey of Expressivity in Deep Neural Networks

We survey results on neural network expressivity described in "On the Expressive Power of Deep Neural Networks". The paper motivates and develops three natural measures of expressiveness, which all display an exponential dependence on the depth of the network. In fact, all of these measures are related to a fourth quantity, trajectory length. This quantity grows exponentially in the depth of the network, and is responsible for the depth sensitivity observed. These results translate to consequences for networks during and after training. They suggest that parameters earlier in a network have greater influence on its expressive power -- in particular, given a layer, its influence on expressivity is determined by the remaining depth of the network after that layer. This is verified with experiments on MNIST and CIFAR-10. We also explore the effect of training on the input-output map, and find that it trades off between the stability and expressivity.

Note on Equivalence Between Recurrent Neural Network Time Series Models and Variational Bayesian Models

We observe that the standard log likelihood training objective for a Recurrent Neural Network (RNN) model of time series data is equivalent to a variational Bayesian training objective, given the proper choice of generative and inference models. This perspective may motivate extensions to both RNNs and variational Bayesian models. We propose one such extension, where multiple particles are used for the hidden state of an RNN, allowing a natural representation of uncertainty or multimodality.

Exponential expressivity in deep neural networks through transient chaos

We combine Riemannian geometry with the mean field theory of high dimensional chaos to study the nature of signal propagation in generic, deep neural networks with random weights. Our results reveal an order-to-chaos expressivity phase transition, with networks in the chaotic phase computing nonlinear functions whose global curvature grows exponentially with depth but not width. We prove this generic class of deep random functions cannot be efficiently computed by any shallow network, going beyond prior work restricted to the analysis of single functions. Moreover, we formalize and quantitatively demonstrate the long conjectured idea that deep networks can disentangle highly curved manifolds in input space into flat manifolds in hidden space. Our theoretical analysis of the expressive power of deep networks broadly applies to arbitrary nonlinearities, and provides a quantitative underpinning for previously abstract notions about the geometry of deep functions.

Hamiltonian Monte Carlo Without Detailed Balance

We present a method for performing Hamiltonian Monte Carlo that largely eliminates sample rejection for typical hyperparameters. In situations that would normally lead to rejection, instead a longer trajectory is computed until a new state is reached that can be accepted. This is achieved using Markov chain transitions that satisfy the fixed point equation, but do not satisfy detailed balance. The resulting algorithm significantly suppresses the random walk behavior and wasted function evaluations that are typically the consequence of update rejection. We demonstrate a greater than factor of two improvement in mixing time on three test problems. We release the source code as Python and MATLAB packages.

A universal tradeoff between power, precision and speed in physical communication

Maximizing the speed and precision of communication while minimizing power dissipation is a fundamental engineering design goal. Also, biological systems achieve remarkable speed, precision and power efficiency using poorly understood physical design principles. Powerful theories like information theory and thermodynamics do not provide general limits on power, precision and speed. Here we go beyond these classical theories to prove that the product of precision and speed is universally bounded by power dissipation in any physical communication channel whose dynamics is faster than that of the signal. Moreover, our derivation involves a novel connection between friction and information geometry. These results may yield insight into both the engineering design of communication devices and the structure and function of biological signaling systems.

Deep Unsupervised Learning using Nonequilibrium Thermodynamics

A central problem in machine learning involves modeling complex data-sets using highly flexible families of probability distributions in which learning, sampling, inference, and evaluation are still analytically or computationally tractable. Here, we develop an approach that simultaneously achieves both flexibility and tractability. The essential idea, inspired by non-equilibrium statistical physics, is to systematically and slowly destroy structure in a data distribution through an iterative forward diffusion process. We then learn a reverse diffusion process that restores structure in data, yielding a highly flexible and tractable generative model of the data. This approach allows us to rapidly learn, sample from, and evaluate probabilities in deep generative models with thousands of layers or time steps, as well as to compute conditional and posterior probabilities under the learned model. We additionally release an open source reference implementation of the algorithm.

A Markov Jump Process for More Efficient Hamiltonian Monte Carlo

In most sampling algorithms, including Hamiltonian Monte Carlo, transition rates between states correspond to the probability of making a transition in a single time step, and are constrained to be less than or equal to 1. We derive a Hamiltonian Monte Carlo algorithm using a continuous time Markov jump process, and are thus able to escape this constraint. Transition rates in a Markov jump process need only be non-negative. We demonstrate that the new algorithm leads to improved mixing for several example problems, both by evaluating the spectral gap of the Markov operator, and by computing autocorrelation as a function of compute time. We release the algorithm as an open source Python package.

Deep Knowledge Tracing

Knowledge tracing---where a machine models the knowledge of a student as they interact with coursework---is a well established problem in computer supported education. Though effectively modeling student knowledge would have high educational impact, the task has many inherent challenges. In this paper we explore the utility of using Recurrent Neural Networks (RNNs) to model student learning. The RNN family of models have important advantages over previous methods in that they do not require the explicit encoding of human domain knowledge, and can capture more complex representations of student knowledge. Using neural networks results in substantial improvements in prediction performance on a range of knowledge tracing datasets. Moreover the learned model can be used for intelligent curriculum design and allows straightforward interpretation and discovery of structure in student tasks. These results suggest a promising new line of research for knowledge tracing and an exemplary application task for RNNs.