We suggest a new loss for learning deep embeddings. The key characteristics of the new loss is the absence of tunable parameters and very good results obtained across a range of datasets and problems. The loss is computed by estimating two distribution of similarities for positive (matching) and negative (non-matching) point pairs, and then computing the probability of a positive pair to have a lower similarity score than a negative pair based on these probability estimates. We show that these operations can be performed in a simple and piecewise-differentiable manner using 1D histograms with soft assignment operations. This makes the proposed loss suitable for learning deep embeddings using stochastic optimization. The experiments reveal favourable results compared to recently proposed loss functions.

Collecting labeled data is costly and thus a critical bottleneck in real-world classification tasks. To mitigate this problem, we propose a novel setting, namely learning from complementary labels for multi-class classification. A complementary label specifies a class that a pattern does not belong to. Collecting complementary labels would be less laborious than collecting ordinary labels, since users do not have to carefully choose the correct class from a long list of candidate classes. However, complementary labels are less informative than ordinary labels and thus a suitable approach is needed to better learn from them. In this paper, we show that an unbiased estimator to the classification risk can be obtained only from complementarily labeled data, if a loss function satisfies a particular symmetric condition. We derive estimation error bounds for the proposed method and prove that the optimal parametric convergence rate is achieved. We further show that learning from complementary labels can be easily combined with learning from ordinary labels (i.e., ordinary supervised learning), providing a highly practical implementation of the proposed method. Finally, we experimentally demonstrate the usefulness of the proposed methods.

In the recent years, a number of parameter-free algorithms have been developed for online linear optimization over Hilbert spaces and for learning with expert advice. These algorithms achieve optimal regret bounds that depend on the unknown competitors, without having to tune the learning rates with oracle choices. We present a new intuitive framework to design parameter-free algorithms for both online linear optimization over Hilbert spaces and for learning with expert advice, based on reductions to betting on outcomes of adversarial coins. We instantiate it using a betting algorithm based on the Krichevsky-Trofimov estimator. The resulting algorithms are simple, with no parameters to be tuned, and they improve or match previous results in terms of regret guarantee and per-round complexity.

We present the first general purpose framework for marginal maximum a posteriori estimation of probabilistic program variables. By using a series of code transformations, the evidence of any probabilistic program, and therefore of any graphical model, can be optimized with respect to an arbitrary subset of its sampled variables. To carry out this optimization, we develop the first Bayesian optimization package to directly exploit the source code of its target, leading to innovations in problem-independent hyperpriors, unbounded optimization, and implicit constraint satisfaction; delivering significant performance improvements over prominent existing packages.

We revisit the classical problem of optimal experimental design (OED) under a new mathematical model grounded in a geometric motivation. Specifically, we introduce models based on elementary symmetric polynomials; these polynomials capture partial volumes and offer a graded interpolation between the widely used A-optimal and D-optimal design models, obtaining each of them as special cases. We analyze properties of our models, and derive both greedy and convex-relaxation algorithms for computing the associated designs. Our analysis establishes approximation guarantees on these algorithms, while our empirical results substantiate our claims and demonstrate a curious phenomenon concerning our greedy algorithm. Finally, as a byproduct, we obtain new results on the theory of elementary symmetric polynomials that may be of independent interest.

We introduce a new machine learning approach for image segmentation that uses a neural network to model the conditional energy of a segmentation given an image. Our approach, combinatorial energy learning for image segmentation (CELIS) places a particular emphasis on modeling the inherent combinatorial nature of dense image segmentation problems. We propose efficient algorithms for learning deep neural networks to model the energy function, and for local optimization of this energy in the space of supervoxel agglomerations. We extensively evaluate our method on a publicly available 3-D microscopy dataset with 25 billion voxels of ground truth data. On an 11 billion voxel test set, we find that our method improves volumetric reconstruction accuracy by more than 20% as compared to two state-of-the-art baseline methods: graph-based segmentation of the output of a 3-D convolutional neural network trained to predict boundaries, as well as a random forest classifier trained to agglomerate supervoxels that were generated by a 3-D convolutional neural network.

An augmented Lagrangian (AL) can convert a constrained optimization problem into a sequence of simpler (e.g., unconstrained) problems which are then usually solved with local solvers. Recently, surrogate-based Bayesian optimization (BO) sub-solvers have been successfully deployed in the AL framework for a more global search in the presence of inequality constraints; however a drawback was that expected improvement (EI) evaluations relied on Monte Carlo. Here we introduce an alternative slack variable AL, and show that in this formulation the EI may be evaluated with library routines. The slack variables furthermore facilitate equality as well as inequality constraints, and mixtures thereof. We show our new slack ALBO compares favorably to the original. Its superiority over conventional alternatives is reinforced on several new mixed constraint examples.

In a regression task, a predictor is given a set of instances, along with a real value for each point. Subsequently, she has to identify the value of a new instance as accurately as possible. In this work, we initiate the study of strategic predictions in machine learning. We consider a regression task tackled by two players, where the payoff of each player is the proportion of the points she predicts more accurately than the other player. We first revise the probably approximately correct learning framework to deal with the case of a duel between two predictors. We then devise an algorithm which finds a linear regression predictor that is a best response to any (not necessarily linear) regression algorithm. We show that it has linearithmic sample complexity, and polynomial time complexity when the dimension of the instances domain is fixed. We also test our approach in a high-dimensional setting, and show it significantly defeats classical regression algorithms in the prediction duel. Together, our work introduces a novel machine learning task that lends itself well to current competitive online settings, provides its theoretical foundations, and illustrates its applicability.

Reasoning about objects, relations, and physics is central to human intelligence, and a key goal of artificial intelligence. Here we introduce the interaction network, a model which can reason about how objects in complex systems interact, supporting dynamical predictions, as well as inferences about the abstract properties of the system. Our model takes graphs as input, performs object-and relation-centric reasoning in a way that is analogous to a simulation, and is implemented using deep neural networks. We evaluate its ability to reason about several challenging physical domains: n-body problems, rigid-body collision, and non-rigid dynamics. Our results show it can be trained to accurately simulate the physical trajectories of dozens of objects over thousands of time steps, estimate abstract quantities such as energy, and generalize automatically to systems with different numbers and configurations of objects and relations. Our interaction network implementation is the first general-purpose, learnable physics engine, and a powerful general framework for reasoning about object and relations in a wide variety of complex real-world domains.

A key problem in structured output prediction is enabling direct optimization of the task reward function that matters for test evaluation. This paper presents a simple and computationally efficient method that incorporates task reward into maximum likelihood training. We establish a connection between maximum likelihood and regularized expected reward, showing that they are approximately equivalent in the vicinity of the optimal solution. Then we show how maximum likelihood can be generalized by optimizing the conditional probability of auxiliary outputs that are sampled proportional to their exponentiated scaled rewards. We apply this framework to optimize edit distance in the output space, by sampling from edited targets. Experiments on speech recognition and machine translation for neural sequence to sequence models show notable improvements over maximum likelihood baseline by simply sampling from target output augmentations.