OpenRaiser/Intern-Atlas huggingface dataset:
Quantifying Availability and Discovery in Recommender Systems via Stochastic Reachability
Venue: Conference ICML 2021
Year: 2021

In this work, we consider how preference models in interactive recommendation systems determine the availability of content and users' opportunities for discovery. We propose an evaluation procedure based on stochastic reachability to quantify the maximum probability of recommending a target piece of content to an user for a set of allowable strategic modifications. This framework allows us to compute an upper bound on the likelihood of recommendation with minimal assumptions about user behavior. Stochastic reachability can be used to detect biases in the availability of content and diagnose limitations in the opportunities for discovery granted to users. We show that this metric can be computed efficiently as a convex program for a variety of practical settings, and further argue that reachability is not inherently at odds with accuracy. We demonstrate evaluations of recommendation algorithms trained on large datasets of explicit and implicit ratings. Our results illustrate how preference models, selection rules, and user interventions impact reachability and how these effects can be distributed unevenly.
Offline Reinforcement Learning with Pseudometric Learning
Venue: Conference ICML 2021
Year: 2021

Offline Reinforcement Learning methods seek to learn a policy from logged transitions of an environment, without any interaction. In the presence of function approximation, and under the assumption of limited coverage of the state-action space of the environment, it is necessary to enforce the policy to visit state-action pairs close to the support of logged transitions. In this work, we propose an iterative procedure to learn a pseudometric (closely related to bisimulation metrics) from logged transitions, and use it to define this notion of closeness. We show its convergence and extend it to the function approximation setting. We then use this pseudometric to define a new lookup based bonus in an actor-critic algorithm: PLOFF. This bonus encourages the actor to stay close, in terms of the defined pseudometric, to the support of logged transitions. Finally, we evaluate the method on hand manipulation and locomotion tasks.
A Tale of Two Efficient and Informative Negative Sampling Distributions
Venue: Conference ICML 2021
Year: 2021

Softmax classifiers with a very large number of classes naturally occur in many applications such as natural language processing and information retrieval. The calculation of full softmax is costly from the computational and energy perspective. There have been various sampling approaches to overcome this challenge, popularly known as negative sampling (NS). Ideally, NS should sample negative classes from a distribution that is dependent on the input data, the current parameters, and the correct positive class. Unfortunately, due to the dynamically updated parameters and data samples, there is no sampling scheme that is provably adaptive and samples the negative classes efficiently. Therefore, alternative heuristics like random sampling, static frequency-based sampling, or learning-based biased sampling, which primarily trade either the sampling cost or the adaptivity of samples per iteration are adopted. In this paper, we show two classes of distributions where the sampling scheme is truly adaptive and provably generates negative samples in near-constant time. Our implementation in C++ on CPU is significantly superior, both in terms of wall-clock time and accuracy, compared to the most optimized TensorFlow implementations of other popular negative sampling approaches on powerful NVIDIA V100 GPU.
Sliced Iterative Normalizing Flows
Venue: Conference ICML 2021
Year: 2021

We develop an iterative (greedy) deep learning (DL) algorithm which is able to transform an arbitrary probability distribution function (PDF) into the target PDF. The model is based on iterative Optimal Transport of a series of 1D slices, matching on each slice the marginal PDF to the target. The axes of the orthogonal slices are chosen to maximize the PDF difference using Wasserstein distance at each iteration, which enables the algorithm to scale well to high dimensions. As special cases of this algorithm, we introduce two sliced iterative Normalizing Flow (SINF) models, which map from the data to the latent space (GIS) and vice versa (SIG). We show that SIG is able to generate high quality samples of image datasets, which match the GAN benchmarks, while GIS obtains competitive results on density estimation tasks compared to the density trained NFs, and is more stable, faster, and achieves higher $p(x)$ when trained on small training sets. SINF approach deviates significantly from the current DL paradigm, as it is greedy and does not use concepts such as mini-batching, stochastic gradient descent and gradient back-propagation through deep layers.
Convex Regularization in Monte-Carlo Tree Search
Venue: Conference ICML 2021
Year: 2021

Monte-Carlo planning and Reinforcement Learning (RL) are essential to sequential decision making. The recent AlphaGo and AlphaZero algorithms have shown how to successfully combine these two paradigms in order to solve large scale sequential decision problems. These methodologies exploit a variant of the well-known UCT algorithm to trade off exploitation of good actions and exploration of unvisited states, but their empirical success comes at the cost of poor sample-efficiency and high computation time. In this paper, we overcome these limitations by considering convex regularization in Monte-Carlo Tree Search (MCTS), which has been successfully used in RL to efficiently drive exploration. First, we introduce a unifying theory on the use of generic convex regularizers in MCTS, deriving the regret analysis and providing guarantees of exponential convergence rate. Second, we exploit our theoretical framework to introduce novel regularized backup operators for MCTS, based on the relative entropy of the policy update, and on the Tsallis entropy of the policy. Finally, we empirically evaluate the proposed operators in AlphaGo and AlphaZero on problems of increasing dimensionality and branching factor, from a toy problem to several Atari games, showing their superiority w.r.t. representative baselines.
Re-understanding Finite-State Representations of Recurrent Policy Networks
Venue: Conference ICML 2021
Year: 2021

We introduce an approach for understanding control policies represented as recurrent neural networks. Recent work has approached this problem by transforming such recurrent policy networks into finite-state machines (FSM) and then analyzing the equivalent minimized FSM. While this led to interesting insights, the minimization process can obscure a deeper understanding of a machine's operation by merging states that are semantically distinct. To address this issue, we introduce an analysis approach that starts with an unminimized FSM and applies more-interpretable reductions that preserve the key decision points of the policy. We also contribute an attention tool to attain a deeper understanding of the role of observations in the decisions. Our case studies on 7 Atari games and 3 control benchmarks demonstrate that the approach can reveal insights that have not been previously noticed.
Intermediate Layer Optimization for Inverse Problems using Deep Generative Models
Venue: Conference ICML 2021
Year: 2021

We propose Intermediate Layer Optimization (ILO), a novel optimization algorithm for solving inverse problems with deep generative models. Instead of optimizing only over the initial latent code, we progressively change the input layer obtaining successively more expressive generators. To explore the higher dimensional spaces, our method searches for latent codes that lie within a small $l_1$ ball around the manifold induced by the previous layer. Our theoretical analysis shows that by keeping the radius of the ball relatively small, we can improve the established error bound for compressed sensing with deep generative models. We empirically show that our approach outperforms state-of-the-art methods introduced in StyleGAN-2 and PULSE for a wide range of inverse problems including inpainting, denoising, super-resolution and compressed sensing.
SAINT-ACC: Safety-Aware Intelligent Adaptive Cruise Control for Autonomous Vehicles Using Deep Reinforcement Learning
Venue: Conference ICML 2021
Year: 2021

We present a novel adaptive cruise control (ACC) system namely SAINT-ACC: {S}afety-{A}ware {Int}elligent {ACC} system (SAINT-ACC) that is designed to achieve simultaneous optimization of traffic efficiency, driving safety, and driving comfort through dynamic adaptation of the inter-vehicle gap based on deep reinforcement learning (RL). A novel dual RL agent-based approach is developed to seek and adapt the optimal balance between traffic efficiency and driving safety/comfort by effectively controlling the driving safety model parameters and inter-vehicle gap based on macroscopic and microscopic traffic information collected from dynamically changing and complex traffic environments. Results obtained through over 12,000 simulation runs with varying traffic scenarios and penetration rates demonstrate that SAINT-ACC significantly enhances traffic flow, driving safety and comfort compared with a state-of-the-art approach.
Lipschitz normalization for self-attention layers with application to graph neural networks
Venue: Conference ICML 2021
Year: 2021

Attention based neural networks are state of the art in a large range of applications. However, their performance tends to degrade when the number of layers increases. In this work, we show that enforcing Lipschitz continuity by normalizing the attention scores can significantly improve the performance of deep attention models. First, we show that, for deep graph attention networks (GAT), gradient explosion appears during training, leading to poor performance of gradient-based training algorithms. To address this issue, we derive a theoretical analysis of the Lipschitz continuity of attention modules and introduce LipschitzNorm, a simple and parameter-free normalization for self-attention mechanisms that enforces the model to be Lipschitz continuous. We then apply LipschitzNorm to GAT and Graph Transformers and show that their performance is substantially improved in the deep setting (10 to 30 layers). More specifically, we show that a deep GAT model with LipschitzNorm achieves state of the art results for node label prediction tasks that exhibit long-range dependencies, while showing consistent improvements over their unnormalized counterparts in benchmark node classification tasks.
Diffusion Source Identification on Networks with Statistical Confidence
Venue: Conference ICML 2021
Year: 2021

Diffusion source identification on networks is a problem of fundamental importance in a broad class of applications, including rumor controlling and virus identification. Though this problem has received significant recent attention, most studies have focused only on very restrictive settings and lack theoretical guarantees for more realistic networks. We introduce a statistical framework for the study of diffusion source identification and develop a confidence set inference approach inspired by hypothesis testing. Our method efficiently produces a small subset of nodes, which provably covers the source node with any pre-specified confidence level without restrictive assumptions on network structures. Moreover, we propose multiple Monte Carlo strategies for the inference procedure based on network topology and the probabilistic properties that significantly improve the scalability. To our knowledge, this is the first diffusion source identification method with a practically useful theoretical guarantee on general networks. We demonstrate our approach via extensive synthetic experiments on well-known random network models and a mobility network between cities concerning the COVID-19 spreading.
Multidimensional Scaling: Approximation and Complexity
Venue: Conference ICML 2021
Year: 2021

Metric Multidimensional scaling (MDS) is a classical method for generating meaningful (non-linear) low-dimensional embeddings of high-dimensional data. MDS has a long history in the statistics, machine learning, and graph drawing communities. In particular, the Kamada-Kawai force-directed graph drawing method is equivalent to MDS and is one of the most popular ways in practice to embed graphs into low dimensions. Despite its ubiquity, our theoretical understanding of MDS remains limited as its objective function is highly non-convex. In this paper, we prove that minimizing the Kamada-Kawai objective is NP-hard and give a provable approximation algorithm for optimizing it, which in particular is a PTAS on low-diameter graphs. We supplement this result with experiments suggesting possible connections between our greedy approximation algorithm and gradient-based methods.
What Does Rotation Prediction Tell Us about Classifier Accuracy under Varying Testing Environments?
Venue: Conference ICML 2021
Year: 2021

Understanding classifier decision under novel environments is central to the community, and a common practice is evaluating it on labeled test sets. However, in real-world testing, image annotations are difficult and expensive to obtain, especially when the test environment is changing. A natural question then arises: given a trained classifier, can we evaluate its accuracy on varying unlabeled test sets? In this work, we train semantic classification and rotation prediction in a multi-task way. On a series of datasets, we report an interesting finding, i.e., the semantic classification accuracy exhibits a strong linear relationship with the accuracy of the rotation prediction task (Pearson's Correlation r > 0.88). This finding allows us to utilize linear regression to estimate classifier performance from the accuracy of rotation prediction which can be obtained on the test set through the freely generated rotation labels.
Toward Better Generalization Bounds with Locally Elastic Stability
Venue: Conference ICML 2021
Year: 2021

Algorithmic stability is a key characteristic to ensure the generalization ability of a learning algorithm. Among different notions of stability, \emph{uniform stability} is arguably the most popular one, which yields exponential generalization bounds. However, uniform stability only considers the worst-case loss change (or so-called sensitivity) by removing a single data point, which is distribution-independent and therefore undesirable. There are many cases that the worst-case sensitivity of the loss is much larger than the average sensitivity taken over the single data point that is removed, especially in some advanced models such as random feature models or neural networks. Many previous works try to mitigate the distribution independent issue by proposing weaker notions of stability, however, they either only yield polynomial bounds or the bounds derived do not vanish as sample size goes to infinity. Given that, we propose \emph{locally elastic stability} as a weaker and distribution-dependent stability notion, which still yields exponential generalization bounds. We further demonstrate that locally elastic stability implies tighter generalization bounds than those derived based on uniform stability in many situations by revisiting the examples of bounded support vector machines, regularized least square regressions, and stochastic gradient descent.
Heterogeneity for the Win: One-Shot Federated Clustering
Venue: Conference ICML 2021
Year: 2021

In this work, we explore the unique challenges -- and opportunities -- of unsupervised federated learning (FL). We develop and analyze a one-shot federated clustering scheme, $k$-FED, based on the widely-used Lloyd's method for $k$-means clustering. In contrast to many supervised problems, we show that the issue of statistical heterogeneity in federated networks can in fact benefit our analysis. We analyse $k$-FED under a center separation assumption and compare it to the best known requirements of its centralized counterpart. Our analysis shows that in heterogeneous regimes where the number of clusters per device $(k')$ is smaller than the total number of clusters over the network $k$, $(k'\le \sqrt{k})$, we can use heterogeneity to our advantage -- significantly weakening the cluster separation requirements for $k$-FED. From a practical viewpoint, $k$-FED also has many desirable properties: it requires only round of communication, can run asynchronously, and can handle partial participation or node/network failures. We motivate our analysis with experiments on common FL benchmarks, and highlight the practical utility of one-shot clustering through use-cases in personalized FL and device sampling.
Bayesian Optimization over Hybrid Spaces
Venue: Conference ICML 2021
Year: 2021

We consider the problem of optimizing hybrid structures (mixture of discrete and continuous input variables) via expensive black-box function evaluations. This problem arises in many real-world applications. For example, in materials design optimization via lab experiments, discrete and continuous variables correspond to the presence/absence of primitive elements and their relative concentrations respectively. The key challenge is to accurately model the complex interactions between discrete and continuous variables. In this paper, we propose a novel approach referred as Hybrid Bayesian Optimization (HyBO) by utilizing diffusion kernels, which are naturally defined over continuous and discrete variables. We develop a principled approach for constructing diffusion kernels over hybrid spaces by utilizing the additive kernel formulation, which allows additive interactions of all orders in a tractable manner. We theoretically analyze the modeling strength of additive hybrid kernels and prove that it has the universal approximation property. Our experiments on synthetic and six diverse real-world benchmarks show that HyBO significantly outperforms the state-of-the-art methods.
Navigation Turing Test (NTT): Learning to Evaluate Human-Like Navigation
Venue: Conference ICML 2021
Year: 2021

A key challenge on the path to developing agents that learn complex human-like behavior is the need to quickly and accurately quantify human-likeness. While human assessments of such behavior can be highly accurate, speed and scalability are limited. We address these limitations through a novel automated Navigation Turing Test (ANTT) that learns to predict human judgments of human-likeness. We demonstrate the effectiveness of our automated NTT on a navigation task in a complex 3D environment. We investigate six classification models to shed light on the types of architectures best suited to this task, and validate them against data collected through a human NTT. Our best models achieve high accuracy when distinguishing true human and agent behavior. At the same time, we show that predicting finer-grained human assessment of agents' progress towards human-like behavior remains unsolved. Our work takes an important step towards agents that more effectively learn complex human-like behavior.
On the Inherent Regularization Effects of Noise Injection During Training
Venue: Conference ICML 2021
Year: 2021

Randomly perturbing networks during the training process is a commonly used approach to improving generalization performance. In this paper, we present a theoretical study of one particular way of random perturbation, which corresponds to injecting artificial noise to the training data. We provide a precise asymptotic characterization of the training and generalization errors of such randomly perturbed learning problems on a random feature model. Our analysis shows that Gaussian noise injection in the training process is equivalent to introducing a weighted ridge regularization, when the number of noise injections tends to infinity. The explicit form of the regularization is also given. Numerical results corroborate our asymptotic predictions, showing that they are accurate even in moderate problem dimensions. Our theoretical predictions are based on a new correlated Gaussian equivalence conjecture that generalizes recent results in the study of random feature models.
Hierarchical Agglomerative Graph Clustering in Nearly-Linear Time
Venue: Conference ICML 2021
Year: 2021

We study the widely used hierarchical agglomerative clustering (HAC) algorithm on edge-weighted graphs. We define an algorithmic framework for hierarchical agglomerative graph clustering that provides the first efficient $\tilde{O}(m)$ time exact algorithms for classic linkage measures, such as complete- and WPGMA-linkage, as well as other measures. Furthermore, for average-linkage, arguably the most popular variant of HAC, we provide an algorithm that runs in $\tilde{O}(n\sqrt{m})$ time. For this variant, this is the first exact algorithm that runs in subquadratic time, as long as $m=n^{2-ε}$ for some constant $ε> 0$. We complement this result with a simple $ε$-close approximation algorithm for average-linkage in our framework that runs in $\tilde{O}(m)$ time. As an application of our algorithms, we consider clustering points in a metric space by first using $k$-NN to generate a graph from the point set, and then running our algorithms on the resulting weighted graph. We validate the performance of our algorithms on publicly available datasets, and show that our approach can speed up clustering of point datasets by a factor of 20.7--76.5x.
ARMS: Antithetic-REINFORCE-Multi-Sample Gradient for Binary Variables
Venue: Conference ICML 2021
Year: 2021

Estimating the gradients for binary variables is a task that arises frequently in various domains, such as training discrete latent variable models. What has been commonly used is a REINFORCE based Monte Carlo estimation method that uses either independent samples or pairs of negatively correlated samples. To better utilize more than two samples, we propose ARMS, an Antithetic REINFORCE-based Multi-Sample gradient estimator. ARMS uses a copula to generate any number of mutually antithetic samples. It is unbiased, has low variance, and generalizes both DisARM, which we show to be ARMS with two samples, and the leave-one-out REINFORCE (LOORF) estimator, which is ARMS with uncorrelated samples. We evaluate ARMS on several datasets for training generative models, and our experimental results show that it outperforms competing methods. We also develop a version of ARMS for optimizing the multi-sample variational bound, and show that it outperforms both VIMCO and DisARM. The code is publicly available.
Coded-InvNet for Resilient Prediction Serving Systems
Venue: Conference ICML 2021
Year: 2021

Inspired by a new coded computation algorithm for invertible functions, we propose Coded-InvNet a new approach to design resilient prediction serving systems that can gracefully handle stragglers or node failures. Coded-InvNet leverages recent findings in the deep learning literature such as invertible neural networks, Manifold Mixup, and domain translation algorithms, identifying interesting research directions that span across machine learning and systems. Our experimental results show that Coded-InvNet can outperform existing approaches, especially when the compute resource overhead is as low as 10%. For instance, without knowing which of the ten workers is going to fail, our algorithm can design a backup task so that it can correctly recover the missing prediction result with an accuracy of 85.9%, significantly outperforming the previous SOTA by 32.5%.