pwc-archive/papers-with-abstracts huggingface dataset:
Differential Privacy Guarantees for Stochastic Gradient Langevin Dynamics
Authors: Théo Ryffel, Francis Bach, David Pointcheval
Date: 2022-01-28 00:00:00

We analyse the privacy leakage of noisy stochastic gradient descent by modeling R\'enyi divergence dynamics with Langevin diffusions. Inspired by recent work on non-stochastic algorithms, we derive similar desirable properties in the stochastic setting. In particular, we prove that the privacy loss converges exponentially fast for smooth and strongly convex objectives under constant step size, which is a significant improvement over previous DP-SGD analyses. We also extend our analysis to arbitrary sequences of varying step sizes and derive new utility bounds. Last, we propose an implementation and our experiments show the practical utility of our approach compared to classical DP-SGD libraries.
Learning to Simulate Unseen Physical Systems with Graph Neural Networks
Authors: Ce Yang, Weihao Gao, Di wu, Chong Wang
Date: 2022-01-28 00:00:00
Proceeding: NeurIPS Workshop AI4Scien 2021 12

Simulation of the dynamics of physical systems is essential to the development of both science and engineering. Recently there is an increasing interest in learning to simulate the dynamics of physical systems using neural networks. However, existing approaches fail to generalize to physical substances not in the training set, such as liquids with different viscosities or elastomers with different elasticities. Here we present a machine learning method embedded with physical priors and material parameters, which we term as "Graph-based Physics Engine" (GPE), to efficiently model the physical dynamics of different substances in a wide variety of scenarios. We demonstrate that GPE can generalize to materials with different properties not seen in the training set and perform well from single-step predictions to multi-step roll-out simulations. In addition, introducing the law of momentum conservation in the model significantly improves the efficiency and stability of learning, allowing convergence to better models with fewer training steps.
Approximately Equivariant Networks for Imperfectly Symmetric Dynamics
Authors: Rui Wang, Robin Walters, Rose Yu
Date: 2022-01-28 00:00:00
Tasks: Inductive Bias

Incorporating symmetry as an inductive bias into neural network architecture has led to improvements in generalization, data efficiency, and physical consistency in dynamics modeling. Methods such as CNNs or equivariant neural networks use weight tying to enforce symmetries such as shift invariance or rotational equivariance. However, despite the fact that physical laws obey many symmetries, real-world dynamical data rarely conforms to strict mathematical symmetry either due to noisy or incomplete data or to symmetry breaking features in the underlying dynamical system. We explore approximately equivariant networks which are biased towards preserving symmetry but are not strictly constrained to do so. By relaxing equivariance constraints, we find that our models can outperform both baselines with no symmetry bias and baselines with overly strict symmetry in both simulated turbulence domains and real-world multi-stream jet flow.
Training invariances and the low-rank phenomenon: beyond linear networks
Authors: Thien Le, Stefanie Jegelka
Date: 2022-01-28 00:00:00
Proceeding: ICLR 2022 4

The implicit bias induced by the training of neural networks has become a topic of rigorous study. In the limit of gradient flow and gradient descent with appropriate step size, it has been shown that when one trains a deep linear network with logistic or exponential loss on linearly separable data, the weights converge to rank-1 matrices. In this paper, we extend this theoretical result to the last few linear layers of the much wider class of nonlinear ReLU-activated feedforward networks containing fully-connected layers and skip connections. Similar to the linear case, the proof relies on specific local training invariances, sometimes referred to as alignment, which we show to hold for submatrices where neurons are stably-activated in all training examples, and it reflects empirical results in the literature. We also show this is not true in general for the full matrix of ReLU fully-connected layers. Our proof relies on a specific decomposition of the network into a multilinear function and another ReLU network whose weights are constant under a certain parameter directional convergence.
Pseudo-Differential Neural Operator: Generalized Fourier Neural Operator for Learning Solution Operators of Partial Differential Equations
Authors: Jin Young Shin, Jae Yong Lee, Hyung Ju Hwang
Date: 2022-01-28 00:00:00

Learning the mapping between two function spaces has garnered considerable research attention. However, learning the solution operator of partial differential equations (PDEs) remains a challenge in scientific computing. Fourier neural operator (FNO) was recently proposed to learn solution operators, and it achieved an excellent performance. In this study, we propose a novel \textit{pseudo-differential integral operator} (PDIO) to analyze and generalize the Fourier integral operator in FNO. PDIO is inspired by a pseudo-differential operator, which is a generalized differential operator characterized by a certain symbol. We parameterize this symbol using a neural network and demonstrate that the neural network-based symbol is contained in a smooth symbol class. Subsequently, we verify that the PDIO is a bounded linear operator, and thus is continuous in the Sobolev space. We combine the PDIO with the neural operator to develop a \textit{pseudo-differential neural operator} (PDNO) and learn the nonlinear solution operator of PDEs. We experimentally validate the effectiveness of the proposed model by utilizing Darcy flow and the Navier-Stokes equation. The obtained results indicate that the proposed PDNO outperforms the existing neural operator approaches in most experiments.
Provably Efficient Primal-Dual Reinforcement Learning for CMDPs with Non-stationary Objectives and Constraints
Authors: Yuhao Ding, Javad Lavaei
Date: 2022-01-28 00:00:00
Tasks: Reinforcement Learning (RL), Safe Exploration

We consider primal-dual-based reinforcement learning (RL) in episodic constrained Markov decision processes (CMDPs) with non-stationary objectives and constraints, which plays a central role in ensuring the safety of RL in time-varying environments. In this problem, the reward/utility functions and the state transition functions are both allowed to vary arbitrarily over time as long as their cumulative variations do not exceed certain known variation budgets. Designing safe RL algorithms in time-varying environments is particularly challenging because of the need to integrate the constraint violation reduction, safe exploration, and adaptation to the non-stationarity. To this end, we identify two alternative conditions on the time-varying constraints under which we can guarantee the safety in the long run. We also propose the \underline{P}eriodically \underline{R}estarted \underline{O}ptimistic \underline{P}rimal-\underline{D}ual \underline{P}roximal \underline{P}olicy \underline{O}ptimization (PROPD-PPO) algorithm that can coordinate with both two conditions. Furthermore, a dynamic regret bound and a constraint violation bound are established for the proposed algorithm in both the linear kernel CMDP function approximation setting and the tabular CMDP setting under two alternative conditions. This paper provides the first provably efficient algorithm for non-stationary CMDPs with safe exploration.
Sharp Threshold for the Frechet Mean (or Median) of Inhomogeneous Erdos-Renyi Random Graphs
Authors: Francois G. Meyer
Date: 2022-01-28 00:00:00

We address the following foundational question: what is the population, and sample, Frechet mean (or median) graph of an ensemble of inhomogeneous Erdos-Renyi random graphs? We prove that if we use the Hamming distance to compute distances between graphs, then the Frechet mean (or median) graph of an ensemble of inhomogeneous random graphs is obtained by thresholding the expected adjacency matrix of the ensemble. We show that the result also holds for the sample mean (or median) when the population expected adjacency matrix is replaced with the sample mean adjacency matrix. Consequently, the Frechet mean (or median) graph of inhomogeneous Erdos-Renyi random graphs exhibits a sharp threshold: it is either the empty graph, or the complete graph. This novel theoretical result has some significant practical consequences; for instance, the Frechet mean of an ensemble of sparse inhomogeneous random graphs is always the empty graph.
Time-Series Anomaly Detection with Implicit Neural Representation
Authors: Kyeong-Joong Jeong, Yong-Min Shin
Date: 2022-01-28 00:00:00
Tasks: Anomaly Detection, Time Series, Time Series Analysis, Time Series Anomaly Detection

Detecting anomalies in multivariate time-series data is essential in many real-world applications. Recently, various deep learning-based approaches have shown considerable improvements in time-series anomaly detection. However, existing methods still have several limitations, such as long training time due to their complex model designs or costly tuning procedures to find optimal hyperparameters (e.g., sliding window length) for a given dataset. In our paper, we propose a novel method called Implicit Neural Representation-based Anomaly Detection (INRAD). Specifically, we train a simple multi-layer perceptron that takes time as input and outputs corresponding values at that time. Then we utilize the representation error as an anomaly score for detecting anomalies. Experiments on five real-world datasets demonstrate that our proposed method outperforms other state-of-the-art methods in performance, training speed, and robustness.
Higher Order Correlation Analysis for Multi-View Learning
Authors: Jiawang Nie, Li Wang, Zequn Zheng
Date: 2022-01-28 00:00:00
Tasks: MULTI-VIEW LEARNING

Multi-view learning is frequently used in data science. The pairwise correlation maximization is a classical approach for exploring the consensus of multiple views. Since the pairwise correlation is inherent for two views, the extensions to more views can be diversified and the intrinsic interconnections among views are generally lost. To address this issue, we propose to maximize higher order correlations. This can be formulated as a low rank approximation problem with the higher order correlation tensor of multi-view data. We use the generating polynomial method to solve the low rank approximation problem. Numerical results on real multi-view data demonstrate that this method consistently outperforms prior existing methods.
Learning Proximal Operators to Discover Multiple Optima
Authors: Lingxiao Li, Noam Aigerman, Vladimir G. Kim, Jiajin Li, Kristjan Greenewald, Mikhail Yurochkin, Justin Solomon
Date: 2022-01-28 00:00:00
Tasks: object-detection, Object Detection

Finding multiple solutions of non-convex optimization problems is a ubiquitous yet challenging task. Most past algorithms either apply single-solution optimization methods from multiple random initial guesses or search in the vicinity of found solutions using ad hoc heuristics. We present an end-to-end method to learn the proximal operator of a family of training problems so that multiple local minima can be quickly obtained from initial guesses by iterating the learned operator, emulating the proximal-point algorithm that has fast convergence. The learned proximal operator can be further generalized to recover multiple optima for unseen problems at test time, enabling applications such as object detection. The key ingredient in our formulation is a proximal regularization term, which elevates the convexity of our training loss: by applying recent theoretical results, we show that for weakly-convex objectives with Lipschitz gradients, training of the proximal operator converges globally with a practical degree of over-parameterization. We further present an exhaustive benchmark for multi-solution optimization to demonstrate the effectiveness of our method.
Unifying Pairwise Interactions in Complex Dynamics
Authors: Oliver M. Cliff, Annie G. Bryant, Joseph T. Lizier, Naotsugu Tsuchiya, Ben D. Fulcher
Date: 2022-01-28 00:00:00
Tasks: Causal Inference, Time Series, Time Series Analysis

Scientists have developed hundreds of techniques to measure the interactions between pairs of processes in complex systems. But these computational methods, from correlation coefficients to causal inference, rely on distinct quantitative theories that remain largely disconnected. Here we introduce a library of 237 statistics of pairwise interactions and assess their behavior on 1053 multivariate time series from a wide range of real-world and model-generated systems. Our analysis highlights new commonalities between different mathematical formulations, providing a unified picture of a rich interdisciplinary literature. Using three real-world case studies, we then show that simultaneously leveraging diverse methods from across science can uncover those most suitable for addressing a given problem, yielding interpretable understanding of the conceptual formulations of pairwise dependence that drive successful performance. Our framework is provided in extendable open software, enabling comprehensive data-driven analysis by integrating decades of methodological advances.
With Greater Distance Comes Worse Performance: On the Perspective of Layer Utilization and Model Generalization
Authors: James Wang, Cheng-Lin Yang
Date: 2022-01-28 00:00:00
Tasks: Generalization Bounds

Generalization of deep neural networks remains one of the main open problems in machine learning. Previous theoretical works focused on deriving tight bounds of model complexity, while empirical works revealed that neural networks exhibit double descent with respect to both training sample counts and the neural network size. In this paper, we empirically examined how different layers of neural networks contribute differently to the model; we found that early layers generally learn representations relevant to performance on both training data and testing data. Contrarily, deeper layers only minimize training risks and fail to generalize well with testing or mislabeled data. We further illustrate the distance of trained weights to its initial value of final layers has high correlation to generalization errors and can serve as an indicator of an overfit of model. Moreover, we show evidence to support post-training regularization by re-initializing weights of final layers. Our findings provide an efficient method to estimate the generalization capability of neural networks, and the insight of those quantitative results may inspire derivation to better generalization bounds that take the internal structure of neural networks into consideration.
Consistent Collaborative Filtering via Tensor Decomposition
Authors: Shiwen Zhao, Charles Crissman, Guillermo R Sapiro
Date: 2022-01-28 00:00:00
Tasks: Collaborative Filtering, Recommendation Systems, Tensor Decomposition

Collaborative filtering is the de facto standard for analyzing users' activities and building recommendation systems for items. In this work we develop Sliced Anti-symmetric Decomposition (SAD), a new model for collaborative filtering based on implicit feedback. In contrast to traditional techniques where a latent representation of users (user vectors) and items (item vectors) are estimated, SAD introduces one additional latent vector to each item, using a novel three-way tensor view of user-item interactions. This new vector extends user-item preferences calculated by standard dot products to general inner products, producing interactions between items when evaluating their relative preferences. SAD reduces to state-of-the-art (SOTA) collaborative filtering models when the vector collapses to 1, while in this paper we allow its value to be estimated from data. Allowing the values of the new item vector to be different from 1 has profound implications. It suggests users may have nonlinear mental models when evaluating items, allowing the existence of cycles in pairwise comparisons. We demonstrate the efficiency of SAD in both simulated and real world datasets containing over 1M user-item interactions. By comparing with seven SOTA collaborative filtering models with implicit feedbacks, SAD produces the most consistent personalized preferences, in the meanwhile maintaining top-level of accuracy in personalized recommendations. We release the model and inference algorithms in a Python library https://github.com/apple/ml-sad.
A Secure and Efficient Federated Learning Framework for NLP
Authors: Jieren Deng, Chenghong Wang, Xianrui Meng, Yijue Wang, Ji Li, Sheng Lin, Shuo Han, Fei Miao, Sanguthevar Rajasekaran, Caiwen Ding
Date: 2022-01-28 00:00:00
Proceeding: EMNLP 2021 11
Tasks: Federated Learning

In this work, we consider the problem of designing secure and efficient federated learning (FL) frameworks. Existing solutions either involve a trusted aggregator or require heavyweight cryptographic primitives, which degrades performance significantly. Moreover, many existing secure FL designs work only under the restrictive assumption that none of the clients can be dropped out from the training protocol. To tackle these problems, we propose SEFL, a secure and efficient FL framework that (1) eliminates the need for the trusted entities; (2) achieves similar and even better model accuracy compared with existing FL designs; (3) is resilient to client dropouts. Through extensive experimental studies on natural language processing (NLP) tasks, we demonstrate that the SEFL achieves comparable accuracy compared to existing FL solutions, and the proposed pruning technique can improve runtime performance up to 13.7x.
Deep Generative Model for Periodic Graphs
Authors: Shiyu Wang, Xiaojie Guo, Liang Zhao
Date: 2022-01-28 00:00:00
Tasks: Decoder, model

Periodic graphs are graphs consisting of repetitive local structures, such as crystal nets and polygon mesh. Their generative modeling has great potential in real-world applications such as material design and graphics synthesis. Classical models either rely on domain-specific predefined generation principles (e.g., in crystal net design), or follow geometry-based prescribed rules. Recently, deep generative models has shown great promise in automatically generating general graphs. However, their advancement into periodic graphs have not been well explored due to several key challenges in 1) maintaining graph periodicity; 2) disentangling local and global patterns; and 3) efficiency in learning repetitive patterns. To address them, this paper proposes Periodical-Graph Disentangled Variational Auto-encoder (PGD-VAE), a new deep generative models for periodic graphs that can automatically learn, disentangle, and generate local and global graph patterns. Specifically, we develop a new periodic graph encoder consisting of global-pattern encoder and local-pattern encoder that ensures to disentangle the representation into global and local semantics. We then propose a new periodic graph decoder consisting of local structure decoder, neighborhood decoder, and global structure decoder, as well as the assembler of their outputs that guarantees periodicity. Moreover, we design a new model learning objective that helps ensure the invariance of local-semantic representations for the graphs with the same local structure. Comprehensive experimental evaluations have been conducted to demonstrate the effectiveness of the proposed method. The code of proposed PGD-VAE is availabe at https://github.com/shi-yu-wang/PGD-VAE.
Simplifying deflation for non-convex optimization with applications in Bayesian inference and topology optimization
Authors: Mohamed Tarek, Yijiang Huang
Date: 2022-01-28 00:00:00
Tasks: Bayesian Inference

Non-convex optimization problems have multiple local optimal solutions. Non-convex optimization problems are commonly found in numerous applications. One of the methods recently proposed to efficiently explore multiple local optimal solutions without random re-initialization relies on the concept of deflation. In this paper, different ways to use deflation in non-convex optimization and nonlinear system solving are discussed. A simple, general and novel deflation constraint is proposed to enable the use of deflation together with existing nonlinear programming solvers or nonlinear system solvers. The connection between the proposed deflation constraint and a minimum distance constraint is presented. Additionally, a number of variations of deflation constraints and their limitations are discussed. Finally, a number of applications of the proposed methodology in the fields of approximate Bayesian inference and topology optimization are presented.
Adaptive Best-of-Both-Worlds Algorithm for Heavy-Tailed Multi-Armed Bandits
Authors: Jiatai Huang, Yan Dai, Longbo Huang
Date: 2022-01-28 00:00:00
Tasks: Multi-Armed Bandits

In this paper, we generalize the concept of heavy-tailed multi-armed bandits to adversarial environments, and develop robust best-of-both-worlds algorithms for heavy-tailed multi-armed bandits (MAB), where losses have $\alpha$-th ($1<\alpha\le 2$) moments bounded by $\sigma^\alpha$, while the variances may not exist. Specifically, we design an algorithm \texttt{HTINF}, when the heavy-tail parameters $\alpha$ and $\sigma$ are known to the agent, \texttt{HTINF} simultaneously achieves the optimal regret for both stochastic and adversarial environments, without knowing the actual environment type a-priori. When $\alpha,\sigma$ are unknown, \texttt{HTINF} achieves a $\log T$-style instance-dependent regret in stochastic cases and $o(T)$ no-regret guarantee in adversarial cases. We further develop an algorithm \texttt{AdaTINF}, achieving $\mathcal O(\sigma K^{1-\nicefrac 1\alpha}T^{\nicefrac{1}{\alpha}})$ minimax optimal regret even in adversarial settings, without prior knowledge on $\alpha$ and $\sigma$. This result matches the known regret lower-bound (Bubeck et al., 2013), which assumed a stochastic environment and $\alpha$ and $\sigma$ are both known. To our knowledge, the proposed \texttt{HTINF} algorithm is the first to enjoy a best-of-both-worlds regret guarantee, and \texttt{AdaTINF} is the first algorithm that can adapt to both $\alpha$ and $\sigma$ to achieve optimal gap-indepedent regret bound in classical heavy-tailed stochastic MAB setting and our novel adversarial formulation.
Task-Aware Network Coding Over Butterfly Network
Authors: Jiangnan Cheng, Sandeep Chinchali, Ao Tang
Date: 2022-01-28 00:00:00

Network coding allows distributed information sources such as sensors to efficiently compress and transmit data to distributed receivers across a bandwidth-limited network. Classical network coding is largely task-agnostic -- the coding schemes mainly aim to faithfully reconstruct data at the receivers, regardless of what ultimate task the received data is used for. In this paper, we analyze a new task-driven network coding problem, where distributed receivers pass transmitted data through machine learning (ML) tasks, which provides an opportunity to improve efficiency by transmitting salient task-relevant data representations. Specifically, we formulate a task-aware network coding problem over a butterfly network in real-coordinate space, where lossy analog compression through principal component analysis (PCA) can be applied. A lower bound for the total loss function for the formulated problem is given, and necessary and sufficient conditions for achieving this lower bound are also provided. We introduce ML algorithms to solve the problem in the general case, and our evaluation demonstrates the effectiveness of task-aware network coding.