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From Deep Additive Kernel Learning to Last-Layer Bayesian Neural Networks via Induced Prior Approximation

Zhao, Wenyuan, Chen, Haoyuan, Liu, Tie, Tuo, Rui, Tian, Chao

arXiv.org Machine Learning

With the strengths of both deep learning and kernel methods like Gaussian Processes (GPs), Deep Kernel Learning (DKL) has gained considerable attention in recent years. From the computational perspective, however, DKL becomes challenging when the input dimension of the GP layer is high. To address this challenge, we propose the Deep Additive Kernel (DAK) model, which incorporates i) an additive structure for the last-layer GP; and ii) induced prior approximation for each GP unit. This naturally leads to a last-layer Bayesian neural network (BNN) architecture. The proposed method enjoys the interpretability of DKL as well as the computational advantages of BNN. Empirical results show that the proposed approach outperforms state-of-the-art DKL methods in both regression and classification tasks.


Reviews: Stochastic Variational Deep Kernel Learning

Neural Information Processing Systems

This is a well-written paper with only a small number of grammatical and presentation errors, e.g. However, the experimental section lacks some detail on the training of DNNs and the pre-training. From the level of detail given it will be hard to reproduce the results. Furthermore the results are not too convincing. The authors claim that "flexible deep kernel GPs achieve superior performance" to DNNs and SVMs.


Stochastic Variational Deep Kernel Learning

Neural Information Processing Systems

Deep kernel learning combines the non-parametric flexibility of kernel methods with the inductive biases of deep learning architectures. We propose a novel deep kernel learning model and stochastic variational inference procedure which generalizes deep kernel learning approaches to enable classification, multi-task learning, additive covariance structures, and stochastic gradient training. Specifically, we apply additive base kernels to subsets of output features from deep neural architectures, and jointly learn the parameters of the base kernels and deep network through a Gaussian process marginal likelihood objective. Within this framework, we derive an efficient form of stochastic variational inference which leverages local kernel interpolation, inducing points, and structure exploiting algebra. We show improved performance over stand alone deep networks, SVMs, and state of the art scalable Gaussian processes on several classification benchmarks, including an airline delay dataset containing 6 million training points, CIFAR, and ImageNet.


Virgo: Scalable Unsupervised Classification of Cosmological Shock Waves

Lamparth, Max, Böss, Ludwig, Steinwandel, Ulrich, Dolag, Klaus

arXiv.org Artificial Intelligence

Cosmological shock waves are essential to understanding the formation of cosmological structures. To study them, scientists run computationally expensive high-resolution 3D hydrodynamic simulations. Interpreting the simulation results is challenging because the resulting data sets are enormous, and the shock wave surfaces are hard to separate and classify due to their complex morphologies and multiple shock fronts intersecting. We introduce a novel pipeline, Virgo, combining physical motivation, scalability, and probabilistic robustness to tackle this unsolved unsupervised classification problem. To this end, we employ kernel principal component analysis with low-rank matrix approximations to denoise data sets of shocked particles and create labeled subsets. We perform supervised classification to recover full data resolution with stochastic variational deep kernel learning. We evaluate on three state-of-the-art data sets with varying complexity and achieve good results. The proposed pipeline runs automatically, has only a few hyperparameters, and performs well on all tested data sets. Our results are promising for large-scale applications, and we highlight now enabled future scientific work.


Stochastic Variational Deep Kernel Learning

Wilson, Andrew G., Hu, Zhiting, Salakhutdinov, Ruslan R., Xing, Eric P.

Neural Information Processing Systems

Deep kernel learning combines the non-parametric flexibility of kernel methods with the inductive biases of deep learning architectures. We propose a novel deep kernel learning model and stochastic variational inference procedure which generalizes deep kernel learning approaches to enable classification, multi-task learning, additive covariance structures, and stochastic gradient training. Specifically, we apply additive base kernels to subsets of output features from deep neural architectures, and jointly learn the parameters of the base kernels and deep network through a Gaussian process marginal likelihood objective. Within this framework, we derive an efficient form of stochastic variational inference which leverages local kernel interpolation, inducing points, and structure exploiting algebra. We show improved performance over stand alone deep networks, SVMs, and state of the art scalable Gaussian processes on several classification benchmarks, including an airline delay dataset containing 6 million training points, CIFAR, and ImageNet.


Stochastic Variational Deep Kernel Learning

Wilson, Andrew Gordon, Hu, Zhiting, Salakhutdinov, Ruslan, Xing, Eric P.

arXiv.org Machine Learning

Deep kernel learning combines the non-parametric flexibility of kernel methods with the inductive biases of deep learning architectures. We propose a novel deep kernel learning model and stochastic variational inference procedure which generalizes deep kernel learning approaches to enable classification, multi-task learning, additive covariance structures, and stochastic gradient training. Specifically, we apply additive base kernels to subsets of output features from deep neural architectures, and jointly learn the parameters of the base kernels and deep network through a Gaussian process marginal likelihood objective. Within this framework, we derive an efficient form of stochastic variational inference which leverages local kernel interpolation, inducing points, and structure exploiting algebra. We show improved performance over stand alone deep networks, SVMs, and state of the art scalable Gaussian processes on several classification benchmarks, including an airline delay dataset containing 6 million training points, CIFAR, and ImageNet.