Unsupervised Out-of-Domain Detection via Pre-trained Transformers

Deployed real-world machine learning applications are often subject to uncontrolled and even potentially malicious inputs. Those out-of-domain inputs can lead to unpredictable outputs and sometimes catastrophic safety issues. Prior studies on out-of-domain detection require in-domain task labels and are limited to supervised classification scenarios. Our work tackles the problem of detecting out-of-domain samples with only unsupervised in-domain data. We utilize the latent representations of pre-trained transformers and propose a simple yet effective method to transform features across all layers to construct out-of-domain detectors efficiently. Two domain-specific fine-tuning approaches are further proposed to boost detection accuracy. Our empirical evaluations of related methods on two datasets validate that our method greatly improves out-of-domain detection ability in a more general scenario.

Nearly Horizon-Free Offline Reinforcement Learning

We revisit offline reinforcement learning on episodic time-homogeneous tabular Markov Decision Processes with $S$ states, $A$ actions and planning horizon $H$. Given the collected $N$ episodes data with minimum cumulative reaching probability $d_m$, we obtain the first set of nearly $H$-free sample complexity bounds for evaluation and planning using the empirical MDPs: 1.For the offline evaluation, we obtain an $\tilde{O}\left(\sqrt{\frac{1}{Nd_m}} \right)$ error rate, which matches the lower bound and does not have additional dependency on $\poly\left(S,A\right)$ in higher-order term, that is different from previous works~\citep{yin2020near,yin2020asymptotically}. 2.For the offline policy optimization, we obtain an $\tilde{O}\left(\sqrt{\frac{1}{Nd_m}} + \frac{S}{Nd_m}\right)$ error rate, improving upon the best known result by \cite{cui2020plug}, which has additional $H$ and $S$ factors in the main term. Furthermore, this bound approaches the $\Omega\left(\sqrt{\frac{1}{Nd_m}}\right)$ lower bound up to logarithmic factors and a high-order term. To the best of our knowledge, these are the first set of nearly horizon-free bounds in offline reinforcement learning.

Combinatorial Bandits without Total Order for Arms

We consider the combinatorial bandits problem, where at each time step, the online learner selects a size-$k$ subset $s$ from the arms set $\mathcal{A}$, where $\left|\mathcal{A}\right| = n$, and observes a stochastic reward of each arm in the selected set $s$. The goal of the online learner is to minimize the regret, induced by not selecting $s^*$ which maximizes the expected total reward. Specifically, we focus on a challenging setting where 1) the reward distribution of an arm depends on the set $s$ it is part of, and crucially 2) there is \textit{no total order} for the arms in $\mathcal{A}$. In this paper, we formally present a reward model that captures set-dependent reward distribution and assumes no total order for arms. Correspondingly, we propose an Upper Confidence Bound (UCB) algorithm that maintains UCB for each individual arm and selects the arms with top-$k$ UCB. We develop a novel regret analysis and show an $O\left(\frac{k^2 n \log T}{\epsilon}\right)$ gap-dependent regret bound as well as an $O\left(k^2\sqrt{n T \log T}\right)$ gap-independent regret bound. We also provide a lower bound for the proposed reward model, which shows our proposed algorithm is near-optimal for any constant $k$. Empirical results on various reward models demonstrate the broad applicability of our algorithm.

Linear Bandit Algorithms with Sublinear Time Complexity

We propose to accelerate existing linear bandit algorithms to achieve per-step time complexity sublinear in the number of arms $K$. The key to sublinear complexity is the realization that the arm selection in many linear bandit algorithms reduces to the maximum inner product search (MIPS) problem. Correspondingly, we propose an algorithm that approximately solves the MIPS problem for a sequence of adaptive queries yielding near-linear preprocessing time complexity and sublinear query time complexity. Using the proposed MIPS solver as a sub-routine, we present two bandit algorithms (one based on UCB, and the other based on TS) that achieve sublinear time complexity. We explicitly characterize the tradeoff between the per-step time complexity and regret, and show that our proposed algorithms can achieve $O(K^{1-\alpha(T)})$ per-step complexity for some $\alpha(T) > 0$ and $\widetilde O(\sqrt{T})$ regret, where $T$ is the time horizon. Further, we present the theoretical limit of the tradeoff, which provides a lower bound for the per-step time complexity. We also discuss other choices of approximate MIPS algorithms and other applications to linear bandit problems.

Accountable Off-Policy Evaluation With Kernel Bellman Statistics

We consider off-policy evaluation (OPE), which evaluates the performance of a new policy from observed data collected from previous experiments, without requiring the execution of the new policy. This finds important applications in areas with high execution cost or safety concerns, such as medical diagnosis, recommendation systems and robotics. In practice, due to the limited information from off-policy data, it is highly desirable to construct rigorous confidence intervals, not just point estimation, for the policy performance. In this work, we propose a new variational framework which reduces the problem of calculating tight confidence bounds in OPE into an optimization problem on a feasible set that catches the true state-action value function with high probability. The feasible set is constructed by leveraging statistical properties of a recently proposed kernel Bellman loss (Feng et al., 2019). We design an efficient computational approach for calculating our bounds, and extend it to perform post-hoc diagnosis and correction for existing estimators. Empirical results show that our method yields tight confidence intervals in different settings.

Stein Self-Repulsive Dynamics: Benefits From Past Samples

We propose a new Stein self-repulsive dynamics for obtaining diversified samples from intractable un-normalized distributions. Our idea is to introduce Stein variational gradient as a repulsive force to push the samples of Langevin dynamics away from the past trajectories. This simple idea allows us to significantly decrease the auto-correlation in Langevin dynamics and hence increase the effective sample size. Importantly, as we establish in our theoretical analysis, the asymptotic stationary distribution remains correct even with the addition of the repulsive force, thanks to the special properties of the Stein variational gradient. We perform extensive empirical studies of our new algorithm, showing that our method yields much higher sample efficiency and better uncertainty estimation than vanilla Langevin dynamics.

MaxUp: A Simple Way to Improve Generalization of Neural Network Training

We propose \emph{MaxUp}, an embarrassingly simple, highly effective technique for improving the generalization performance of machine learning models, especially deep neural networks. The idea is to generate a set of augmented data with some random perturbations or transforms and minimize the maximum, or worst case loss over the augmented data. By doing so, we implicitly introduce a smoothness or robustness regularization against the random perturbations, and hence improve the generation performance. For example, in the case of Gaussian perturbation, \emph{MaxUp} is asymptotically equivalent to using the gradient norm of the loss as a penalty to encourage smoothness. We test \emph{MaxUp} on a range of tasks, including image classification, language modeling, and adversarial certification, on which \emph{MaxUp} consistently outperforms the existing best baseline methods, without introducing substantial computational overhead. In particular, we improve ImageNet classification from the state-of-the-art top-1 accuracy $85.5\%$ without extra data to $85.8\%$. Code will be released soon.

Implicit Regularization of Normalization Methods

Normalization methods such as batch normalization are commonly used in overparametrized models like neural networks. Here, we study the weight normalization (WN) method (Salimans & Kingma, 2016) and a variant called reparametrized projected gradient descent (rPGD) for overparametrized least squares regression and some more general loss functions. WN and rPGD reparametrize the weights with a scale $g$ and a unit vector such that the objective function becomes \emph{non-convex}. We show that this non-convex formulation has beneficial regularization effects compared to gradient descent on the original objective. We show that these methods adaptively regularize the weights and \emph{converge with exponential rate} to the minimum $\ell_2$ norm solution (or close to it) even for initializations \emph{far from zero}. This is different from the behavior of gradient descent, which only converges to the min norm solution when started at zero, and is more sensitive to initialization. Some of our proof techniques are different from many related works; for instance we find explicit invariants along the gradient flow paths. We verify our results experimentally and suggest that there may be a similar phenomenon for nonlinear problems such as matrix sensing.

Function Space Particle Optimization for Bayesian Neural Networks

While Bayesian neural networks (BNNs) have drawn increasing attention, their posterior inference remains challenging, due to the high-dimensional and over-parameterized nature. To address this issue, several highly flexible and scalable variational inference procedures based on the idea of particle optimization have been proposed. These methods directly optimize a set of particles to approximate the target posterior. However, their application to BNNs often yields sub-optimal performance, as such methods have a particular failure mode on over-parameterized models. In this paper, we propose to solve this issue by performing particle optimization directly in the space of regression functions. We demonstrate through extensive experiments that our method successfully overcomes this issue, and outperforms strong baselines in a variety of tasks including prediction, defense against adversarial examples, and reinforcement learning.