pwc-archive/papers-with-abstracts huggingface dataset:
MisConv: Convolutional Neural Networks for Missing Data
Authors: Marcin Przewięźlikowski, Marek Śmieja, Łukasz Struski, Jacek Tabor
Date: 2021-10-26 00:00:00
Tasks: Image Inpainting, Imputation, Missing Values

Processing of missing data by modern neural networks, such as CNNs, remains a fundamental, yet unsolved challenge, which naturally arises in many practical applications, like image inpainting or autonomous vehicles and robots. While imputation-based techniques are still one of the most popular solutions, they frequently introduce unreliable information to the data and do not take into account the uncertainty of estimation, which may be destructive for a machine learning model. In this paper, we present MisConv, a general mechanism, for adapting various CNN architectures to process incomplete images. By modeling the distribution of missing values by the Mixture of Factor Analyzers, we cover the spectrum of possible replacements and find an analytical formula for the expected value of convolution operator applied to the incomplete image. The whole framework is realized by matrix operations, which makes MisConv extremely efficient in practice. Experiments performed on various image processing tasks demonstrate that MisConv achieves superior or comparable performance to the state-of-the-art methods.
Cluster-and-Conquer: A Framework For Time-Series Forecasting
Authors: Reese Pathak, Rajat Sen, Nikhil Rao, N. Benjamin Erichson, Michael I. Jordan, Inderjit S. Dhillon
Date: 2021-10-26 00:00:00
Tasks: Time Series, Time Series Analysis, Time Series Forecasting

We propose a three-stage framework for forecasting high-dimensional time-series data. Our method first estimates parameters for each univariate time series. Next, we use these parameters to cluster the time series. These clusters can be viewed as multivariate time series, for which we then compute parameters. The forecasted values of a single time series can depend on the history of other time series in the same cluster, accounting for intra-cluster similarity while minimizing potential noise in predictions by ignoring inter-cluster effects. Our framework -- which we refer to as "cluster-and-conquer" -- is highly general, allowing for any time-series forecasting and clustering method to be used in each step. It is computationally efficient and embarrassingly parallel. We motivate our framework with a theoretical analysis in an idealized mixed linear regression setting, where we provide guarantees on the quality of the estimates. We accompany these guarantees with experimental results that demonstrate the advantages of our framework: when instantiated with simple linear autoregressive models, we are able to achieve state-of-the-art results on several benchmark datasets, sometimes outperforming deep-learning-based approaches.
Reliable and Trustworthy Machine Learning for Health Using Dataset Shift Detection
Authors: Chunjong Park, Anas Awadalla, Tadayoshi Kohno, Shwetak Patel
Date: 2021-10-26 00:00:00
Proceeding: NeurIPS 2021 12
Tasks: BIG-bench Machine Learning, Diagnostic, Medical Diagnosis, Out-of-Distribution Detection

Unpredictable ML model behavior on unseen data, especially in the health domain, raises serious concerns about its safety as repercussions for mistakes can be fatal. In this paper, we explore the feasibility of using state-of-the-art out-of-distribution detectors for reliable and trustworthy diagnostic predictions. We select publicly available deep learning models relating to various health conditions (e.g., skin cancer, lung sound, and Parkinson's disease) using various input data types (e.g., image, audio, and motion data). We demonstrate that these models show unreasonable predictions on out-of-distribution datasets. We show that Mahalanobis distance- and Gram matrices-based out-of-distribution detection methods are able to detect out-of-distribution data with high accuracy for the health models that operate on different modalities. We then translate the out-of-distribution score into a human interpretable CONFIDENCE SCORE to investigate its effect on the users' interaction with health ML applications. Our user study shows that the \textsc{confidence score} helped the participants only trust the results with a high score to make a medical decision and disregard results with a low score. Through this work, we demonstrate that dataset shift is a critical piece of information for high-stake ML applications, such as medical diagnosis and healthcare, to provide reliable and trustworthy predictions to the users.
The Difficulty of Passive Learning in Deep Reinforcement Learning
Authors: Georg Ostrovski, Pablo Samuel Castro, Will Dabney
Date: 2021-10-26 00:00:00
Proceeding: NeurIPS 2021 12
Tasks: Deep Reinforcement Learning, reinforcement-learning, Reinforcement Learning, Reinforcement Learning (RL)

Learning to act from observational data without active environmental interaction is a well-known challenge in Reinforcement Learning (RL). Recent approaches involve constraints on the learned policy or conservative updates, preventing strong deviations from the state-action distribution of the dataset. Although these methods are evaluated using non-linear function approximation, theoretical justifications are mostly limited to the tabular or linear cases. Given the impressive results of deep reinforcement learning, we argue for a need to more clearly understand the challenges in this setting. In the vein of Held & Hein's classic 1963 experiment, we propose the "tandem learning" experimental paradigm which facilitates our empirical analysis of the difficulties in offline reinforcement learning. We identify function approximation in conjunction with fixed data distributions as the strongest factors, thereby extending but also challenging hypotheses stated in past work. Our results provide relevant insights for offline deep reinforcement learning, while also shedding new light on phenomena observed in the online case of learning control.
Improving Local Effectiveness for Global robust training
Authors: Jingyue Lu, M. Pawan Kumar
Date: 2021-10-26 00:00:00

Despite its popularity, deep neural networks are easily fooled. To alleviate this deficiency, researchers are actively developing new training strategies, which encourage models that are robust to small input perturbations. Several successful robust training methods have been proposed. However, many of them rely on strong adversaries, which can be prohibitively expensive to generate when the input dimension is high and the model structure is complicated. We adopt a new perspective on robustness and propose a novel training algorithm that allows a more effective use of adversaries. Our method improves the model robustness at each local ball centered around an adversary and then, by combining these local balls through a global term, achieves overall robustness. We demonstrate that, by maximizing the use of adversaries via focusing on local balls, we achieve high robust accuracy with weak adversaries. Specifically, our method reaches a similar robust accuracy level to the state of the art approaches trained on strong adversaries on MNIST, CIFAR-10 and CIFAR-100. As a result, the overall training time is reduced. Furthermore, when trained with strong adversaries, our method matches with the current state of the art on MNIST and outperforms them on CIFAR-10 and CIFAR-100.
Surrogate Regret Bounds for Polyhedral Losses
Authors: Rafael Frongillo, Bo Waggoner
Date: 2021-10-26 00:00:00
Proceeding: NeurIPS 2021 12

Surrogate risk minimization is an ubiquitous paradigm in supervised machine learning, wherein a target problem is solved by minimizing a surrogate loss on a dataset. Surrogate regret bounds, also called excess risk bounds, are a common tool to prove generalization rates for surrogate risk minimization. While surrogate regret bounds have been developed for certain classes of loss functions, such as proper losses, general results are relatively sparse. We provide two general results. The first gives a linear surrogate regret bound for any polyhedral (piecewise-linear and convex) surrogate, meaning that surrogate generalization rates translate directly to target rates. The second shows that for sufficiently non-polyhedral surrogates, the regret bound is a square root, meaning fast surrogate generalization rates translate to slow rates for the target. Together, these results suggest polyhedral surrogates are optimal in many cases.
Robustness of Graph Neural Networks at Scale
Authors: Simon Geisler, Tobias Schmidt, Hakan Şirin, Daniel Zügner, Aleksandar Bojchevski, Stephan Günnemann
Date: 2021-10-26 00:00:00
Proceeding: NeurIPS 2021 12
Tasks: Diversity

Graph Neural Networks (GNNs) are increasingly important given their popularity and the diversity of applications. Yet, existing studies of their vulnerability to adversarial attacks rely on relatively small graphs. We address this gap and study how to attack and defend GNNs at scale. We propose two sparsity-aware first-order optimization attacks that maintain an efficient representation despite optimizing over a number of parameters which is quadratic in the number of nodes. We show that common surrogate losses are not well-suited for global attacks on GNNs. Our alternatives can double the attack strength. Moreover, to improve GNNs' reliability we design a robust aggregation function, Soft Median, resulting in an effective defense at all scales. We evaluate our attacks and defense with standard GNNs on graphs more than 100 times larger compared to previous work. We even scale one order of magnitude further by extending our techniques to a scalable GNN.
Conflict-Averse Gradient Descent for Multi-task Learning
Authors: Bo Liu, Xingchao Liu, Xiaojie Jin, Peter Stone, Qiang Liu
Date: 2021-10-26 00:00:00
Proceeding: NeurIPS 2021 12
Tasks: Multi-Task Learning

The goal of multi-task learning is to enable more efficient learning than single task learning by sharing model structures for a diverse set of tasks. A standard multi-task learning objective is to minimize the average loss across all tasks. While straightforward, using this objective often results in much worse final performance for each task than learning them independently. A major challenge in optimizing a multi-task model is the conflicting gradients, where gradients of different task objectives are not well aligned so that following the average gradient direction can be detrimental to specific tasks' performance. Previous work has proposed several heuristics to manipulate the task gradients for mitigating this problem. But most of them lack convergence guarantee and/or could converge to any Pareto-stationary point. In this paper, we introduce Conflict-Averse Gradient descent (CAGrad) which minimizes the average loss function, while leveraging the worst local improvement of individual tasks to regularize the algorithm trajectory. CAGrad balances the objectives automatically and still provably converges to a minimum over the average loss. It includes the regular gradient descent (GD) and the multiple gradient descent algorithm (MGDA) in the multi-objective optimization (MOO) literature as special cases. On a series of challenging multi-task supervised learning and reinforcement learning tasks, CAGrad achieves improved performance over prior state-of-the-art multi-objective gradient manipulation methods.
Beta Shapley: a Unified and Noise-reduced Data Valuation Framework for Machine Learning
Authors: Yongchan Kwon, James Zou
Date: 2021-10-26 00:00:00
Tasks: BIG-bench Machine Learning, Data Valuation

Data Shapley has recently been proposed as a principled framework to quantify the contribution of individual datum in machine learning. It can effectively identify helpful or harmful data points for a learning algorithm. In this paper, we propose Beta Shapley, which is a substantial generalization of Data Shapley. Beta Shapley arises naturally by relaxing the efficiency axiom of the Shapley value, which is not critical for machine learning settings. Beta Shapley unifies several popular data valuation methods and includes data Shapley as a special case. Moreover, we prove that Beta Shapley has several desirable statistical properties and propose efficient algorithms to estimate it. We demonstrate that Beta Shapley outperforms state-of-the-art data valuation methods on several downstream ML tasks such as: 1) detecting mislabeled training data; 2) learning with subsamples; and 3) identifying points whose addition or removal have the largest positive or negative impact on the model.
How to transfer algorithmic reasoning knowledge to learn new algorithms?
Authors: Louis-Pascal A. C. Xhonneux, Andreea Deac, Petar Velickovic, Jian Tang
Date: 2021-10-26 00:00:00
Proceeding: NeurIPS 2021 12
Tasks: Learning to Execute, Multi-Task Learning

Learning to execute algorithms is a fundamental problem that has been widely studied. Prior work~\cite{veli19neural} has shown that to enable systematic generalisation on graph algorithms it is critical to have access to the intermediate steps of the program/algorithm. In many reasoning tasks, where algorithmic-style reasoning is important, we only have access to the input and output examples. Thus, inspired by the success of pre-training on similar tasks or data in Natural Language Processing (NLP) and Computer Vision, we set out to study how we can transfer algorithmic reasoning knowledge. Specifically, we investigate how we can use algorithms for which we have access to the execution trace to learn to solve similar tasks for which we do not. We investigate two major classes of graph algorithms, parallel algorithms such as breadth-first search and Bellman-Ford and sequential greedy algorithms such as Prim and Dijkstra. Due to the fundamental differences between algorithmic reasoning knowledge and feature extractors such as used in Computer Vision or NLP, we hypothesise that standard transfer techniques will not be sufficient to achieve systematic generalisation. To investigate this empirically we create a dataset including 9 algorithms and 3 different graph types. We validate this empirically and show how instead multi-task learning can be used to achieve the transfer of algorithmic reasoning knowledge.
Meta-learning with an Adaptive Task Scheduler
Authors: Huaxiu Yao, Yu Wang, Ying WEI, Peilin Zhao, Mehrdad Mahdavi, Defu Lian, Chelsea Finn
Date: 2021-10-26 00:00:00
Proceeding: NeurIPS 2021 12
Tasks: Drug Discovery, Meta-Learning

To benefit the learning of a new task, meta-learning has been proposed to transfer a well-generalized meta-model learned from various meta-training tasks. Existing meta-learning algorithms randomly sample meta-training tasks with a uniform probability, under the assumption that tasks are of equal importance. However, it is likely that tasks are detrimental with noise or imbalanced given a limited number of meta-training tasks. To prevent the meta-model from being corrupted by such detrimental tasks or dominated by tasks in the majority, in this paper, we propose an adaptive task scheduler (ATS) for the meta-training process. In ATS, for the first time, we design a neural scheduler to decide which meta-training tasks to use next by predicting the probability being sampled for each candidate task, and train the scheduler to optimize the generalization capacity of the meta-model to unseen tasks. We identify two meta-model-related factors as the input of the neural scheduler, which characterize the difficulty of a candidate task to the meta-model. Theoretically, we show that a scheduler taking the two factors into account improves the meta-training loss and also the optimization landscape. Under the setting of meta-learning with noise and limited budgets, ATS improves the performance on both miniImageNet and a real-world drug discovery benchmark by up to 13% and 18%, respectively, compared to state-of-the-art task schedulers.
Drawing Robust Scratch Tickets: Subnetworks with Inborn Robustness Are Found within Randomly Initialized Networks
Authors: Yonggan Fu, Qixuan Yu, Yang Zhang, Shang Wu, Xu Ouyang, David Cox, Yingyan Celine Lin
Date: 2021-10-26 00:00:00
Proceeding: NeurIPS 2021 12
Tasks: Adversarial Robustness

Deep Neural Networks (DNNs) are known to be vulnerable to adversarial attacks, i.e., an imperceptible perturbation to the input can mislead DNNs trained on clean images into making erroneous predictions. To tackle this, adversarial training is currently the most effective defense method, by augmenting the training set with adversarial samples generated on the fly. Interestingly, we discover for the first time that there exist subnetworks with inborn robustness, matching or surpassing the robust accuracy of the adversarially trained networks with comparable model sizes, within randomly initialized networks without any model training, indicating that adversarial training on model weights is not indispensable towards adversarial robustness. We name such subnetworks Robust Scratch Tickets (RSTs), which are also by nature efficient. Distinct from the popular lottery ticket hypothesis, neither the original dense networks nor the identified RSTs need to be trained. To validate and understand this fascinating finding, we further conduct extensive experiments to study the existence and properties of RSTs under different models, datasets, sparsity patterns, and attacks, drawing insights regarding the relationship between DNNs' robustness and their initialization/overparameterization. Furthermore, we identify the poor adversarial transferability between RSTs of different sparsity ratios drawn from the same randomly initialized dense network, and propose a Random RST Switch (R2S) technique, which randomly switches between different RSTs, as a novel defense method built on top of RSTs. We believe our findings about RSTs have opened up a new perspective to study model robustness and extend the lottery ticket hypothesis.
Fault-Tolerant Federated Reinforcement Learning with Theoretical Guarantee
Authors: Flint Xiaofeng Fan, Yining Ma, Zhongxiang Dai, Wei Jing, Cheston Tan, Bryan Kian Hsiang Low
Date: 2021-10-26 00:00:00
Proceeding: NeurIPS 2021 12
Tasks: Decision Making, Federated Learning, reinforcement-learning, Reinforcement Learning, Reinforcement Learning (RL)

The growing literature of Federated Learning (FL) has recently inspired Federated Reinforcement Learning (FRL) to encourage multiple agents to federatively build a better decision-making policy without sharing raw trajectories. Despite its promising applications, existing works on FRL fail to I) provide theoretical analysis on its convergence, and II) account for random system failures and adversarial attacks. Towards this end, we propose the first FRL framework the convergence of which is guaranteed and tolerant to less than half of the participating agents being random system failures or adversarial attackers. We prove that the sample efficiency of the proposed framework is guaranteed to improve with the number of agents and is able to account for such potential failures or attacks. All theoretical results are empirically verified on various RL benchmark tasks.
Adversarial Online Learning with Variable Plays in the Pursuit-Evasion Game: Theoretical Foundations and Application in Connected and Automated Vehicle Cybersecurity
Authors: Yiyang Wang, Neda Masoud
Date: 2021-10-26 00:00:00

We extend the adversarial/non-stochastic multi-play multi-armed bandit (MPMAB) to the case where the number of arms to play is variable. The work is motivated by the fact that the resources allocated to scan different critical locations in an interconnected transportation system change dynamically over time and depending on the environment. By modeling the malicious hacker and the intrusion monitoring system as the attacker and the defender, respectively, we formulate the problem for the two players as a sequential pursuit-evasion game. We derive the condition under which a Nash equilibrium of the strategic game exists. For the defender side, we provide an exponential-weighted based algorithm with sublinear pseudo-regret. We further extend our model to heterogeneous rewards for both players, and obtain lower and upper bounds on the average reward for the attacker. We provide numerical experiments to demonstrate the effectiveness of a variable-arm play.
Learning-Augmented $k$-means Clustering
Authors: Jon C. Ergun, Zhili Feng, Sandeep Silwal, David P. Woodruff, Samson Zhou
Date: 2021-10-27 00:00:00
Proceeding: ICLR 2022 4
Tasks: Clustering

$k$-means clustering is a well-studied problem due to its wide applicability. Unfortunately, there exist strong theoretical limits on the performance of any algorithm for the $k$-means problem on worst-case inputs. To overcome this barrier, we consider a scenario where "advice" is provided to help perform clustering. Specifically, we consider the $k$-means problem augmented with a predictor that, given any point, returns its cluster label in an approximately optimal clustering up to some, possibly adversarial, error. We present an algorithm whose performance improves along with the accuracy of the predictor, even though na\"{i}vely following the accurate predictor can still lead to a high clustering cost. Thus if the predictor is sufficiently accurate, we can retrieve a close to optimal clustering with nearly optimal runtime, breaking known computational barriers for algorithms that do not have access to such advice. We evaluate our algorithms on real datasets and show significant improvements in the quality of clustering.
Towards Robust Bisimulation Metric Learning
Authors: Mete Kemertas, Tristan Aumentado-Armstrong
Date: 2021-10-27 00:00:00
Proceeding: NeurIPS 2021 12
Tasks: continuous-control, Continuous Control, Deep Reinforcement Learning, Informativeness, Metric Learning, Representation Learning

Learned representations in deep reinforcement learning (DRL) have to extract task-relevant information from complex observations, balancing between robustness to distraction and informativeness to the policy. Such stable and rich representations, often learned via modern function approximation techniques, can enable practical application of the policy improvement theorem, even in high-dimensional continuous state-action spaces. Bisimulation metrics offer one solution to this representation learning problem, by collapsing functionally similar states together in representation space, which promotes invariance to noise and distractors. In this work, we generalize value function approximation bounds for on-policy bisimulation metrics to non-optimal policies and approximate environment dynamics. Our theoretical results help us identify embedding pathologies that may occur in practical use. In particular, we find that these issues stem from an underconstrained dynamics model and an unstable dependence of the embedding norm on the reward signal in environments with sparse rewards. Further, we propose a set of practical remedies: (i) a norm constraint on the representation space, and (ii) an extension of prior approaches with intrinsic rewards and latent space regularization. Finally, we provide evidence that the resulting method is not only more robust to sparse reward functions, but also able to solve challenging continuous control tasks with observational distractions, where prior methods fail.