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Title: Bayesian Deep Learning via Stochastic Gradient MCMC with a Stochastic Approximation Adaptation

Paper content:
We propose a robust Bayesian deep learning algorithm to infer complex posteriors with latent variables.
Inspired by dropout, a popular tool for regularization and model ensemble, we assign sparse priors to the weights in deep neural networks (DNN) in order to achieve automatic “dropout” and avoid over-fitting.
By alternatively sampling from posterior distribution through stochastic gradient Markov Chain Monte Carlo (SG-MCMC) and optimizing latent variables via stochastic approximation (SA), the trajectory of the target weights is proved to converge to the true posterior distribution conditioned on optimal latent variables.
This ensures a stronger regularization on the over-fitted parameter space and more accurate uncertainty quantification on the decisive variables.
Simulations from large-p-small-n regressions showcase the robustness of this method when applied to models with latent variables.
Additionally, its application on the convolutional neural networks (CNN) leads to state-of-the-art performance on MNIST and Fashion MNIST datasets and improved resistance to adversarial attacks.
Bayesian deep learning, which evolved from Bayesian neural networks (Neal, 1996; BID4 , provides an alternative to point estimation due to its close connection to both Bayesian probability theory and cutting-edge deep learning models.
It has been shown of the merit to quantify uncertainty BID6 , which not only increases the predictive power of DNN, but also further provides a more robust estimation to enhance AI safety.
Particularly, BID5 BID3 described dropout (Srivastava et al., 2014) as a variational Bayesian approximation.
Through enabling dropout in the testing period, the randomly dropped neurons generate some amount of uncertainty with almost no added cost.
However, the dropout Bayesian approximation is variational inference (VI) based thus it is vulnerable to underestimating uncertainty.MCMC, known for its asymptotically accurate posterior inference, has not been fully investigated in DNN due to its unscalability in dealing with big data and large models.
Stochastic gradient Langevin dynamics (SGLD) (Welling and Teh, 2011) , the first SG-MCMC algorithm, tackled this issue by adding noise to a standard stochastic gradient optimization, smoothing the transition between optimization and sampling.
Considering the pathological curvature that causes the SGLD methods inefficient in DNN models, BID15 proposed combining adaptive preconditioners with SGLD (pSGLD) to adapt to the local geometry and obtained state-of-the-art performance on MNIST dataset.
To avoid SGLD's random-walk behavior, BID3 proposed using stochastic gradient Hamiltonian Monte Carlo (SGHMC), a second-order Langevin dynamics with a large friction term, which was shown to have lower autocorrelation time and faster convergence BID2 .
Saatci and Wilson (2017) used SGHMC with GANs BID8 ) to achieve a fully probabilistic inference and showed the Bayesian GAN model with only 100 labeled images was able to achieve 99.3% testing accuracy in MNIST dataset.
Raginsky et al. (2017) ; Zhang et al. (2017) ; Xu et al. (2018) provided theoretical interpretations of SGLD from the perspective of non-convex optimization, echoing the empirical fact that SGLD works well in practice.When the number of predictors exceeds the number of observations, applying the spike-and-slab priors is particularly powerful and efficient to avoid over-fitting by assigning less probability mass on
We propose a mixed sampling-optimization method called SG-MCMC-SA to efficiently sample from complex DNN posteriors with latent variables and prove its convergence.
By adaptively searching and penalizing the over-fitted parameter space, the proposed method improves the generalizability of deep neural networks.
This method is less affected by the hyperparameters, achieves higher prediction accuracy over the traditional SG-MCMC methods in both simulated examples and real applications and shows more robustness towards adversarial attacks.Interesting future directions include applying SG-MCMC-SA towards popular large deep learning models such as the residual network BID11 on CIFAR-10 and CIFAR-100, combining active learning and uncertainty quantification to learn from datasets of smaller size and proving posterior consistency and the consistency of variable selection under various shrinkage priors concretely.

assistant: text: a robust Bayesian deep learning algorithm to infer complex posteriors with latent variables