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What is a Good Metric to Study Generalization of Minimax Learners?

Neural Information Processing Systems

Minimax optimization has served as the backbone of many machine learning problems. Although the convergence behavior of optimization algorithms has been extensively studied in minimax settings, their generalization guarantees, i.e., how the model trained on empirical data performs on the unseen testing data, have been relatively under-explored. A fundamental question remains elusive: What is a good metric to study generalization of minimax learners? In this paper, we aim to answer this question by first showing that primal risk, a universal metric to study generalization in minimization problems, fails in simple examples of minimax problems. Furthermore, another popular metric, the primal-dual risk, also fails to characterize the generalization behavior for minimax problems with nonconvexity, due to non-existence of saddle points. We thus propose a new metric to study generalization of minimax learners: the primal gap, to circumvent these issues.


Adversarially Robust Learning: A Generic Minimax Optimal Learner and Characterization

Neural Information Processing Systems

We present a minimax optimal learner for the problem of learning predictors robust to adversarial examples at test-time. Interestingly, we find that this requires new algorithmic ideas and approaches to adversarially robust learning. In particular, we show, in a strong negative sense, the suboptimality of the robust learner proposed by Montasser, Hanneke, and Srebro [2019] and a broader family of learners we identify as local learners. Our results are enabled by adopting a global perspective, specifically, through a key technical contribution: the the global one-inclusion graph, which may be of independent interest, that generalizes the classical one-inclusion graph due to Haussler, Littlestone, and Warmuth [1994]. Finally, as a byproduct, we identify a dimension characterizing qualitatively and quantitatively what classes of predictors \mathcal{H} are robustly learnable.


When can Regression-Adjusted Control Variate Help? Rare Events, Sobolev Embedding and Minimax Optimality

Neural Information Processing Systems

This paper studies the use of a machine learning-based estimator as a control variate for mitigating the variance of Monte Carlo sampling. Specifically, we seek to uncover the key factors that influence the efficiency of control variates in reducing variance. We examine a prototype estimation problem that involves simulating the moments of a Sobolev function based on observations obtained from (random) quadrature nodes. Firstly, we establish an information-theoretic lower bound for the problem. We then study a specific quadrature rule that employs a nonparametric regression-adjusted control variate to reduce the variance of the Monte Carlo simulation.


Planning from Pixels in Environments with Combinatorially Hard Search Spaces

Neural Information Processing Systems

The ability to form complex plans based on raw visual input is a litmus test for current capabilities of artificial intelligence, as it requires a seamless combination of visual processing and abstract algorithmic execution, two traditionally separate areas of computer science. A recent surge of interest in this field brought advances that yield good performance in tasks ranging from arcade games to continuous control; these methods however do not come without significant issues, such as limited generalization capabilities and difficulties when dealing with combinatorially hard planning instances. Our contribution is two-fold: (i) we present a method that learns to represent its environment as a latent graph and leverages state reidentification to reduce the complexity of finding a good policy from exponential to linear (ii) we introduce a set of lightweight environments with an underlying discrete combinatorial structure in which planning is challenging even for humans. Moreover, we show that our methods achieves strong empirical generalization to variations in the environment, even across highly disadvantaged regimes, such as "one-shot" planning, or in an offline RL paradigm which only provides low-quality trajectories.


Finding Second-Order Stationary Points in Nonconvex-Strongly-Concave Minimax Optimization

Neural Information Processing Systems

Most of existing works focus on finding the first-order stationary point of the function f({\bf x},{\bf y}) or its primal function P({\bf x})\triangleq \max_{\bf y} f({\bf x},{\bf y}), but few of them focus on achieving the second-order stationary point, which is essential to nonconvex problems. In addition, we propose an inexact variant of MCN for high-dimensional problems to avoid calling the expensive second-order oracles. Instead, our method solves the cubic sub-problem inexactly via gradient descent and matrix Chebyshev expansion. This strategy still obtains the desired approximate second-order stationary point with high probability but only requires \tilde{\mathcal O}\left(\kappa {1.5}\ell\varepsilon {-2}\right) Hessian-vector oracle calls and \tilde{\mathcal O}\left(\kappa {2}\sqrt{\rho}\varepsilon {-1.5}\right) first-order oracle calls. To the best of our knowledge, this is the first work that considers the non-asymptotic convergence behavior of finding second-order stationary points for minimax problems without the convex-concave assumptions.


Adaptive Sampling for Minimax Fair Classification

Neural Information Processing Systems

Machine learning models trained on uncurated datasets can often end up adversely affecting inputs belonging to underrepresented groups. To address this issue, we consider the problem of adaptively constructing training sets which allow us to learn classifiers that are fair in a {\em minimax} sense. We first propose an adaptive sampling algorithm based on the principle of \emph{optimism}, and derive theoretical bounds on its performance. We also propose heuristic extensions of this algorithm suitable for application to large scale, practical problems. Next, by deriving algorithm independent lower-bounds for a specific class of problems, we show that the performance achieved by our adaptive scheme cannot be improved in general.


NuTrea: Neural Tree Search for Context-guided Multi-hop KGQA

Neural Information Processing Systems

Multi-hop Knowledge Graph Question Answering (KGQA) is a task that involves retrieving nodes from a knowledge graph (KG) to answer natural language questions. Recent GNN-based approaches formulate this task as a KG path searching problem, where messages are sequentially propagated from the seed node towards the answer nodes. However, these messages are past-oriented, and they do not consider the full KG context. To make matters worse, KG nodes often represent pronoun entities and are sometimes encrypted, being uninformative in selecting between paths. To address these problems, we propose Neural Tree Search (NuTrea), a tree search-based GNN model that incorporates the broader KG context.


Left Heavy Tails and the Effectiveness of the Policy and Value Networks in DNN-based best-first search for Sokoban Planning

Neural Information Processing Systems

Despite the success of practical solvers in various NP-complete domains such as SAT and CSP as well as using deep reinforcement learning to tackle two-player games such as Go, certain classes of PSPACE-hard planning problems have remained out of reach. Even carefully designed domain-specialized solvers can fail quickly due to the exponential search space on hard instances. Recent works that combine traditional search methods, such as best-first search and Monte Carlo tree search, with Deep Neural Networks' (DNN) heuristics have shown promising progress and can solve a significant number of hard planning instances beyond specialized solvers. To better understand why these approaches work, we studied the interplay of the policy and value networks of DNN-based best-first search on Sokoban and show the surprising effectiveness of the policy network, further enhanced by the value network, as a guiding heuristic for the search. To further understand the phenomena, we studied the cost distribution of the search algorithms and found that Sokoban instances can have heavy-tailed runtime distributions, with tails both on the left and right-hand sides.


Learning to Schedule Heuristics in Branch and Bound

Neural Information Processing Systems

Primal heuristics play a crucial role in exact solvers for Mixed Integer Programming (MIP). While solvers are guaranteed to find optimal solutions given sufficient time, real-world applications typically require finding good solutions early on in the search to enable fast decision-making. While much of MIP research focuses on designing effective heuristics, the question of how to manage multiple MIP heuristics in a solver has not received equal attention. Generally, solvers follow hard-coded rules derived from empirical testing on broad sets of instances. Since the performance of heuristics is problem-dependent, using these general rules for a particular problem might not yield the best performance.


Bring Your Own Algorithm for Optimal Differentially Private Stochastic Minimax Optimization

Neural Information Processing Systems

We study differentially private (DP) algorithms for smooth stochastic minimax optimization, with stochastic minimization as a byproduct. The holy grail of these settings is to guarantee the optimal trade-off between the privacy and the excess population loss, using an algorithm with a linear time-complexity in the number of training samples. We provide a general framework for solving differentially private stochastic minimax optimization (DP-SMO) problems, which enables the practitioners to bring their own base optimization algorithm and use it as a black-box to obtain the near-optimal privacy-loss trade-off. Our framework is inspired from the recently proposed Phased-ERM method [22] for nonsmooth differentially private stochastic convex optimization (DP-SCO), which exploits the stability of the empirical risk minimization (ERM) for the privacy guarantee. The flexibility of our approach enables us to sidestep the requirement that the base algorithm needs to have bounded sensitivity, and allows the use of sophisticated variance-reduced accelerated methods to achieve near-linear time-complexity.