Many recent Markov chain Monte Carlo (MCMC) samplers leverage continuous dynamics to define a transition kernel that efficiently explores a target distribution. In tandem, a focus has been on devising scalable variants that subsample the data and use stochastic gradients in place of full-data gradients in the dynamic simulations. However, such stochastic gradient MCMC samplers have lagged behind their full-data counterparts in terms of the complexity of dynamics considered since proving convergence in the presence of the stochastic gradient noise is non-trivial. Even with simple dynamics, significant physical intuition is often required to modify the dynamical system to account for the stochastic gradient noise. In this paper, we provide a general recipe for constructing MCMC samplers--including stochastic gradient versions--based on continuous Markov processes specified via two matrices. We constructively prove that the framework is complete. That is, any continuous Markov process that provides samples from the target distribution can be written in our framework. We show how previous continuous-dynamic samplers can be trivially reinvented in our framework, avoiding the complicated sampler-specific proofs. We likewise use our recipe to straightforwardly propose a new state-adaptive sampler: stochastic gradient Riemann Hamiltonian Monte Carlo (SGRHMC). Our experiments on simulated data and a streaming Wikipedia analysis demonstrate that the proposed SGRHMC sampler inherits the benefits of Riemann HMC, with the scalability of stochastic gradient methods.

Existing inverse reinforcement learning (IRL) algorithms have assumed each expert’s demonstrated trajectory to be produced by only a single reward function. This paper presents a novel generalization of the IRL problem that allows each trajectory to be generated by multiple locally consistent reward functions, hence catering to more realistic and complex experts’ behaviors. Solving our generalized IRL problem thus involves not only learning these reward functions but also the stochastic transitions between them at any state (including unvisited states). By representing our IRL problem with a probabilistic graphical model, an expectation-maximization (EM) algorithm can be devised to iteratively learn the different reward functions and the stochastic transitions between them in order to jointly improve the likelihood of the expert’s demonstrated trajectories. As a result, the most likely partition of a trajectory into segments that are generated from different locally consistent reward functions selected by EM can be derived. Empirical evaluation on synthetic and real-world datasets shows that our IRL algorithm outperforms the state-of-the-art EM clustering with maximum likelihood IRL, which is, interestingly, a reduced variant of our approach.

High dimensional regression benefits from sparsity promoting regularizations. Screening rules leverage the known sparsity of the solution by ignoring some variables in the optimization, hence speeding up solvers. When the procedure is proven not to discard features wrongly the rules are said to be safe. In this paper we derive new safe rules for generalized linear models regularized with L1 and L1/L2 norms. The rules are based on duality gap computations and spherical safe regions whose diameters converge to zero. This allows to discard safely more variables, in particular for low regularization parameters. The GAP Safe rule can cope with any iterative solver and we illustrate its performance on coordinate descent for multi-task Lasso, binary and multinomial logistic regression, demonstrating significant speed ups on all tested datasets with respect to previous safe rules.

State-of-the-art object detection networks depend on region proposal algorithms to hypothesize object locations. Advances like SPPnet and Fast R-CNN have reduced the running time of these detection networks, exposing region proposal computation as a bottleneck. In this work, we introduce a Region Proposal Network (RPN) that shares full-image convolutional features with the detection network, thus enabling nearly cost-free region proposals. An RPN is a fully-convolutional network that simultaneously predicts object bounds and objectness scores at each position. RPNs are trained end-to-end to generate high-quality region proposals, which are used by Fast R-CNN for detection. With a simple alternating optimization, RPN and Fast R-CNN can be trained to share convolutional features. For the very deep VGG-16 model, our detection system has a frame rate of 5fps (including all steps) on a GPU, while achieving state-of-the-art object detection accuracy on PASCAL VOC 2007 (73.2% mAP) and 2012 (70.4% mAP) using 300 proposals per image. Code is available at https://github.com/ShaoqingRen/faster_rcnn.

The alternating direction method of multipliers (ADMM) is an important tool for solving complex optimization problems, but it involves minimization sub-steps that are often difficult to solve efficiently. The Primal-Dual Hybrid Gradient (PDHG) method is a powerful alternative that often has simpler substeps than ADMM, thus producing lower complexity solvers. Despite the flexibility of this method, PDHG is often impractical because it requires the careful choice of multiple stepsize parameters. There is often no intuitive way to choose these parameters to maximize efficiency, or even achieve convergence. We propose self-adaptive stepsize rules that automatically tune PDHG parameters for optimal convergence. We rigorously analyze our methods, and identify convergence rates. Numerical experiments show that adaptive PDHG has strong advantages over non-adaptive methods in terms of both efficiency and simplicity for the user.

In many learning problems, ranging from clustering to ranking through metric learning, empirical estimates of the risk functional consist of an average over tuples (e.g., pairs or triplets) of observations, rather than over individual observations. In this paper, we focus on how to best implement a stochastic approximation approach to solve such risk minimization problems. We argue that in the large-scale setting, gradient estimates should be obtained by sampling tuples of data points with replacement (incomplete U-statistics) instead of sampling data points without replacement (complete U-statistics based on subsamples). We develop a theoretical framework accounting for the substantial impact of this strategy on the generalization ability of the prediction model returned by the Stochastic Gradient Descent (SGD) algorithm. It reveals that the method we promote achieves a much better trade-off between statistical accuracy and computational cost. Beyond the rate bound analysis, experiments on AUC maximization and metric learning provide strong empirical evidence of the superiority of the proposed approach.

We propose a general framework for studying adaptive regret bounds in the online learning setting, subsuming model selection and data-dependent bounds. Given a data- or model-dependent bound we ask, “Does there exist some algorithm achieving this bound?” We show that modifications to recently introduced sequential complexity measures can be used to answer this question by providing sufficient conditions under which adaptive rates can be achieved. In particular each adaptive rate induces a set of so-called offset complexity measures, and obtaining small upper bounds on these quantities is sufficient to demonstrate achievability. A cornerstone of our analysis technique is the use of one-sided tail inequalities to bound suprema of offset random processes.Our framework recovers and improves a wide variety of adaptive bounds including quantile bounds, second order data-dependent bounds, and small loss bounds. In addition we derive a new type of adaptive bound for online linear optimization based on the spectral norm, as well as a new online PAC-Bayes theorem.

Orthogonal Nonnegative Matrix Factorization {(ONMF)} aims to approximate a nonnegative matrix as the product of two $k$-dimensional nonnegative factors, one of which has orthonormal columns. It yields potentially useful data representations as superposition of disjoint parts, while it has been shown to work well for clustering tasks where traditional methods underperform. Existing algorithms rely mostly on heuristics, which despite their good empirical performance, lack provable performance guarantees.We present a new ONMF algorithm with provable approximation guarantees.For any constant dimension~$k$, we obtain an additive EPTAS without any assumptions on the input. Our algorithm relies on a novel approximation to the related Nonnegative Principal Component Analysis (NNPCA) problem; given an arbitrary data matrix, NNPCA seeks $k$ nonnegative components that jointly capture most of the variance. Our NNPCA algorithm is of independent interest and generalizes previous work that could only obtain guarantees for a single component. We evaluate our algorithms on several real and synthetic datasets and show that their performance matches or outperforms the state of the art.

We consider the problem of efficiently computing the maximum likelihood estimator in Generalized Linear Models (GLMs)when the number of observations is much larger than the number of coefficients (n > > p > > 1). In this regime, optimization algorithms can immensely benefit fromapproximate second order information.We propose an alternative way of constructing the curvature information by formulatingit as an estimation problem and applying a Stein-type lemma, which allows further improvements through sub-sampling andeigenvalue thresholding.Our algorithm enjoys fast convergence rates, resembling that of second order methods, with modest per-iteration cost. We provide its convergence analysis for the case where the rows of the design matrix are i.i.d. samples with bounded support.We show that the convergence has two phases, aquadratic phase followed by a linear phase. Finally,we empirically demonstrate that our algorithm achieves the highest performancecompared to various algorithms on several datasets.

We propose rectified factor networks (RFNs) to efficiently construct very sparse, non-linear, high-dimensional representations of the input. RFN models identify rare and small events, have a low interference between code units, have a small reconstruction error, and explain the data covariance structure. RFN learning is a generalized alternating minimization algorithm derived from the posterior regularization method which enforces non-negative and normalized posterior means. We proof convergence and correctness of the RFN learning algorithm.On benchmarks, RFNs are compared to other unsupervised methods like autoencoders, RBMs, factor analysis, ICA, and PCA. In contrast to previous sparse coding methods, RFNs yield sparser codes, capture the data's covariance structure more precisely, and have a significantly smaller reconstruction error. We test RFNs as pretraining technique of deep networks on different vision datasets, where RFNs were superior to RBMs and autoencoders. On gene expression data from two pharmaceutical drug discovery studies, RFNs detected small and rare gene modules that revealed highly relevant new biological insights which were so far missed by other unsupervised methods.RFN package for GPU/CPU is available at http://www.bioinf.jku.at/software/rfn.