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Reinforcement Learning

Jean Tarbouriech, Tor Lattimore, Brendan O'Donoghue

A popular perspective in Reinforcement learning (RL) casts the problem as probabilistic inference on a graphical model of the Markov decision process (MDP). The core object of study is the probability of each state-action pair being visited under the optimal policy. Previous approaches to approximate this quantity can be arbitrarily poor, leading to algorithms that do not implement genuine statistical inference and consequently do not perform well in challenging problems. In this work, we undertake a rigorous Bayesian treatment of the posterior probability of state-action optimality and clarify how it flows through the MDP. We first reveal that this quantity can indeed be used to generate a policy that explores efficiently, as measured by regret. Unfortunately, computing it is intractable, so we derive a new variational Bayesian approximation yielding a tractable convex optimization problem and establish that the resulting policy also explores efficiently. We call our approach VAPOR and show that it has strong connections to Thompson sampling, K-learning, and maximum entropy exploration. We conclude with some experiments demonstrating the performance advantage of a deep RL version of VAPOR.

Nate Gruver, Marc Finzi, Shikai Qiu, Andrew Wilson

By encoding time series as a string of numerical digits, we can frame time series forecasting as next-token prediction in text. Developing this approach, we find that large language models (LLMs) such as GPT-3 and LLaMA-2 can surprisingly zero-shot extrapolate time series at a level comparable to or exceeding the performance of purpose-built time series models trained on the downstream tasks. To facilitate this performance, we propose procedures for effectively tokenizing time series data and converting discrete distributions over tokens into highly flexible densities over continuous values. We argue the success of LLMs for time series stems from their ability to naturally represent multimodal distributions, in conjunction with biases for simplicity, and repetition, which align with the salient features in many time series, such as repeated seasonal trends. We also show how LLMs can naturally handle missing data without imputation through non-numerical text, accommodate textual side information, and answer questions to help explain predictions. While we find that increasing model size generally improves performance on time series, we show GPT-4 can perform worse than GPT-3 because of how it tokenizes numbers, and poor uncertainty calibration, which is likely the result of alignment interventions such as RLHF.

Deep Learning/Generative Models and Autoencoders

Tejas Jayashankar, Gary C.F. Lee, Alejandro Lancho, Amir Weiss, Yury Polyanskiy, Gregory Wornell

We propose a new method for separating superimposed sources using diffusion-based generative models. Our method relies only on separately trained statistical priors of independent sources to establish a new objective function guided by $\textit{maximum a posteriori}$ estimation with an $\textit{$\alpha$-posterior}$, across multiple levels of Gaussian smoothing. Motivated by applications in radio-frequency (RF) systems, we are interested in sources with underlying discrete nature and the recovery of encoded bits from a signal of interest, as measured by the bit error rate (BER). Experimental results with RF mixtures demonstrate that our method results in a BER reduction of 95\% over classical and existing learning-based methods. Our analysis demonstrates that our proposed method yields solutions that asymptotically approach the modes of an underlying discrete distribution. Furthermore, our method can be viewed as a multi-source extension to the recently proposed score distillation sampling scheme, shedding additional light on its use beyond conditional sampling. The project webpage is available at https://alpha-rgs.github.io.

Social Aspects/Fairness, Equity, Justice and Safety

Hailey Joren, Chirag Nagpal, Katherine Heller, Berk Ustun

Machine learning models are often personalized based on information that is protected, sensitive, self-reported, or costly to acquire. These models use information about people, but do not facilitate nor inform their *consent*. Individuals cannot opt out of reporting information that a model needs to personalize their predictions nor tell if they benefit from personalization in the first place. We introduce a new family of prediction models, called participatory systems, that let individuals opt into personalization at prediction time. We present a model-agnostic algorithm to learn participatory systems for supervised learning tasks where models are personalized with categorical group attributes. We conduct a comprehensive empirical study of participatory systems in clinical prediction tasks, comparing them to common approaches for personalization and imputation. Our results show that participatory systems can facilitate and inform consent in a way that improves performance and privacy across all groups who report personal data.

Applications/Language, Speech and Dialog

Chenyang Le, Yao Qian, Long Zhou, Shujie LIU, Yanmin Qian, Michael Zeng, Xuedong Huang

Joint speech-language training is challenging due to the large demand for training data and GPU consumption, as well as the modality gap between speech and language. We present ComSL, a speech-language model built atop a composite architecture of public pre-trained speech-only and language-only models and optimized data-efficiently for spoken language tasks. Particularly, we propose to incorporate cross-modality learning into transfer learning and conduct them simultaneously for downstream tasks in a multi-task learning manner. Our approach has demonstrated effectiveness in end-to-end speech-to-text translation tasks, achieving a new state-of-the-art average BLEU score of 31.5 on the multilingual speech to English text translation task for 21 languages, as measured on the public CoVoST2 evaluation set.

Theory/Learning Theory

Maria-Florina Balcan, Anh Nguyen, Dravyansh Sharma

The task of tuning regularization coefficients in regularized regression models with provable guarantees across problem instances still poses a significant challenge in the literature. This paper investigates the sample complexity of tuning regularization parameters in linear and logistic regressions under $\ell_1$ and $\ell_2$-constraints in the data-driven setting. For the linear regression problem, by more carefully exploiting the structure of the dual function class, we provide a new upper bound for the pseudo-dimension of the validation loss function class, which significantly improves the best-known results on the problem. Remarkably, we also instantiate the first matching lower bound, proving our results are tight. For tuning the regularization parameters of logistic regression, we introduce a new approach to studying the learning guarantee via an approximation of the validation loss function class. We examine the pseudo-dimension of the approximation class and construct a uniform error bound between the validation loss function class and its approximation, which allows us to instantiate the first learning guarantee for the problem of tuning logistic regression regularization coefficients.

Deep Learning/Algorithms

Sara Babakniya, Zalan Fabian, Chaoyang He, Mahdi Soltanolkotabi, Salman Avestimehr

Deep learning models often suffer from forgetting previously learned information when trained on new data. This problem is exacerbated in federated learning (FL), where the data is distributed and can change independently for each user. Many solutions are proposed to resolve this catastrophic forgetting in a centralized setting. However, they do not apply directly to FL because of its unique complexities, such as privacy concerns and resource limitations. To overcome these challenges, this paper presents a framework for \textbf{federated class incremental learning} that utilizes a generative model to synthesize samples from past distributions. This data can be later exploited alongside the training data to mitigate catastrophic forgetting. To preserve privacy, the generative model is trained on the server using data-free methods at the end of each task without requesting data from clients. Moreover, our solution does not demand the users to store old data or models, which gives them the freedom to join/leave the training at any time. Additionally, we introduce SuperImageNet, a new regrouping of the ImageNet dataset specifically tailored for federated continual learning. We demonstrate significant improvements compared to existing baselines through extensive experiments on multiple datasets.

Reinforcement Learning

Ruida Zhou, Tao Liu, Min Cheng, Dileep Kalathil, P. R. Kumar, Chao Tian

We study robust reinforcement learning (RL) with the goal of determining a well-performing policy that is robust against model mismatch between the training simulator and the testing environment. Previous policy-based robust RL algorithms mainly focus on the tabular setting under uncertainty sets that facilitate robust policy evaluation, but are no longer tractable when the number of states scales up. To this end, we propose two novel uncertainty set formulations, one based on double sampling and the other on an integral probability metric. Both make large-scale robust RL tractable even when one only has access to a simulator. We propose a robust natural actor-critic (RNAC) approach that incorporates the new uncertainty sets and employs function approximation. We provide finite-time convergence guarantees for the proposed RNAC algorithm to the optimal robust policy within the function approximation error. Finally, we demonstrate the robust performance of the policy learned by our proposed RNAC approach in multiple MuJoCo environments and a real-world TurtleBot navigation task.

Deep Learning

Zhanpeng Zhou, Yongyi Yang, Xiaojiang Yang, Junchi Yan, Wei Hu

Recent work has revealed many intriguing empirical phenomena in neural network training, despite the poorly understood and highly complex loss landscapes and training dynamics. One of these phenomena, Linear Mode Connectivity (LMC), has gained considerable attention due to the intriguing observation that different solutions can be connected by a linear path in the parameter space while maintaining near-constant training and test losses. In this work, we introduce a stronger notion of linear connectivity, Layerwise Linear Feature Connectivity (LLFC), which says that the feature maps of every layer in different trained networks are also linearly connected. We provide comprehensive empirical evidence for LLFC across a wide range of settings, demonstrating that whenever two trained networks satisfy LMC (via either spawning or permutation methods), they also satisfy LLFC in nearly all the layers. Furthermore, we delve deeper into the underlying factors contributing to LLFC, which reveal new insights into the permutation approaches. The study of LLFC transcends and advances our understanding of LMC by adopting a feature-learning perspective.

Deep Learning/Generative Models and Autoencoders

Dave Epstein, Allan Jabri, Ben Poole, Alexei Efros, Aleksander Holynski

Large-scale generative models are capable of producing high-quality images from detailed prompts. However, many aspects of an image are difficult or impossible to convey through text. We introduce self-guidance, a method that provides precise control over properties of the generated image by guiding the internal representations of diffusion models. We demonstrate that the size, location, and appearance of objects can be extracted from these representations, and show how to use them to steer the sampling process. Self-guidance operates similarly to standard classifier guidance, but uses signals present in the pretrained model itself, requiring no additional models or training. We demonstrate the flexibility and effectiveness of self-guided generation through a wide range of challenging image manipulations, such as modifying the position or size of a single object (keeping the rest of the image unchanged), merging the appearance of objects in one image with the layout of another, composing objects from multiple images into one, and more. We also propose a new method for reconstruction using self-guidance, which allows extending our approach to editing real images.

Applications/Robotics

Tsun-Hsuan Johnson Wang, Juntian Zheng, Pingchuan Ma, Yilun Du, Byungchul Kim, Andrew Spielberg, Josh Tenenbaum, Chuang Gan, Daniela Rus

Nature evolves creatures with a high complexity of morphological and behavioral intelligence, meanwhile computational methods lag in approaching that diversity and efficacy. Co-optimization of artificial creatures' morphology and control in silico shows promise for applications in physical soft robotics and virtual character creation; such approaches, however, require developing new learning algorithms that can reason about function atop pure structure. In this paper, we present DiffuseBot, a physics-augmented diffusion model that generates soft robot morphologies capable of excelling in a wide spectrum of tasks. \name bridges the gap between virtually generated content and physical utility by (i) augmenting the diffusion process with a physical dynamical simulation which provides a certificate of performance, and (ii) introducing a co-design procedure that jointly optimizes physical design and control by leveraging information about physical sensitivities from differentiable simulation. We showcase a range of simulated and fabricated robots along with their capabilities. Check our website: https://diffusebot.github.io/

Probabilistic Methods/Bayesian Models and Methods

Caleb Dahlke, Jason Pacheco

Gaussian mixture models (GMMs) are fundamental to machine learning due to their flexibility as approximating densities. However, uncertainty quantification of GMMs remains a challenge as differential entropy lacks a closed form. This paper explores polynomial approximations, specifically Taylor and Legendre, to the GMM entropy from a theoretical and practical perspective. We provide new analysis of a widely used approach due to Huber et al.(2008) and show that the series diverges under simple conditions. Motivated by this divergence we provide a novel Taylor series that is provably convergent to the true entropy of any GMM. We demonstrate a method for selecting a center such that the series converges from below, providing a lower bound on GMM entropy. Furthermore, we demonstrate that orthogonal polynomial series result in more accurate polynomial approximations. Experimental validation supports our theoretical results while showing that our method is comparable in computation to Huber et al. We also show that in application, the use of these polynomial approximations, such as in Nonparametric Variational Inference by Gershamn et al. (2012), rely on the convergence of the methods in computing accurate approximations. This work contributes useful analysis to existing methods while introducing a novel approximation supported by firm theoretical guarantees.

Reinforcement Learning/Batch Offline

Peng Cheng, Xianyuan Zhan, zhihao wu, Wenjia Zhang, Youfang Lin, Shou cheng Song, Han Wang, Li Jiang

Offline reinforcement learning (RL) offers an appealing approach to real-world tasks by learning policies from pre-collected datasets without interacting with the environment. However, the performance of existing offline RL algorithms heavily depends on the scale and state-action space coverage of datasets. Real-world data collection is often expensive and uncontrollable, leading to small and narrowly covered datasets and posing significant challenges for practical deployments of offline RL. In this paper, we provide a new insight that leveraging the fundamental symmetry of system dynamics can substantially enhance offline RL performance under small datasets. Specifically, we propose a Time-reversal symmetry (T-symmetry) enforced Dynamics Model (TDM), which establishes consistency between a pair of forward and reverse latent dynamics. TDM provides both well-behaved representations for small datasets and a new reliability measure for OOD samples based on compliance with the T-symmetry. These can be readily used to construct a new offline RL algorithm (TSRL) with less conservative policy constraints and a reliable latent space data augmentation procedure. Based on extensive experiments, we find TSRL achieves great performance on small benchmark datasets with as few as 1% of the original samples, which significantly outperforms the recent offline RL algorithms in terms of data efficiency and generalizability. Code is available at:https://github.com/pcheng2/TSRL

Optimization/Stochastic

Ta Duy Nguyen, Thien H Nguyen, Alina Ene, Huy Nguyen

In this work, we study the convergence in high probability of clipped gradient methods when the noise distribution has heavy tails, i.e., with bounded $p$th moments, for some $1<p\le2$. Prior works in this setting follow the same recipe of using concentration inequalities and an inductive argument with union bound to bound the iterates across all iterations. This method results in an increase in the failure probability by a factor of $T$, where $T$ is the number of iterations. We instead propose a new analysis approach based on bounding the moment generating function of a well chosen supermartingale sequence. We improve the dependency on $T$ in the convergence guarantee for a wide range of algorithms with clipped gradients, including stochastic (accelerated) mirror descent for convex objectives and stochastic gradient descent for nonconvex objectives. Our high probability bounds achieve the optimal convergence rates and match the best currently known in-expectation bounds. Our approach naturally allows the algorithms to use time-varying step sizes and clipping parameters when the time horizon is unknown, which appears difficult or even impossible using the techniques from prior works. Furthermore, we show that in the case of clipped stochastic mirror descent, several problem constants, including the initial distance to the optimum, are not required when setting step sizes and clipping parameters.

Applications/Computer Vision

Liulei Li, Jianan Wei, Wenguan Wang, Yi Yang

The interaction decoder utilized in prevalent Transformer-based HOI detectors typically accepts pre-composed human-object pairs as inputs. Though achieving remarkable performance, such a paradigm lacks feasibility and cannot explore novel combinations over entities during decoding. We present LogicHOI, a new HOI detector that leverages neural-logic reasoning and Transformer to infer feasible interactions between. entities. Specifically, we modify. self-attention mechanism in the vanilla Transformer, enabling it to reason over the ⟨ human, action, object ⟩ triplet and constitute novel interactions. Meanwhile, such a reasoning process is guided by two crucial properties for understanding HOI: affordances (the potential actions an object can facilitate) and proxemics (the spatial relations between humans and objects). We formulate these two properties in first-order logic and ground them into continuous space to constrain the learning process of our approach, leading to improved performance and zero-shot generalization capabilities. We evaluate L OGIC HOI on V-COCO and HICO-DET under both normal and zero-shot setups, achieving significant improvements over existing methods.

Applications/Physics

Zongyi Li, Nikola Kovachki, Chris Choy, Boyi Li, Jean Kossaifi, Shourya Otta, Mohammad Amin Nabian, Maximilian Stadler, Christian Hundt, Kamyar Azizzadenesheli 等

We propose the geometry-informed neural operator (GINO), a highly efficient approach for learning the solution operator of large-scale partial differential equations with varying geometries. GINO uses a signed distance function (SDF) representation of the input shape and neural operators based on graph and Fourier architectures to learn the solution operator. The graph neural operator handles irregular grids and transforms them into and from regular latent grids on which Fourier neural operator can be efficiently applied. We provide an efficient implementation of GINO using an optimized hashing approach, which allows efficient learning in a shared, compressed latent space with reduced computation and memory costs. GINO is discretization-invariant, meaning the trained model can be applied to arbitrary discretizations of the continuous domain and applies to any shape or resolution. To empirically validate the performance of our method on large-scale simulation, we generate the industry-standard aerodynamics dataset of 3D vehicle geometries with Reynolds numbers as high as five million. For this large-scale 3D fluid simulation, numerical methods are expensive to compute surface pressure. We successfully trained GINO to predict the pressure on car surfaces using only five hundred data points. The cost-accuracy experiments show a 26,000x speed-up compared to optimized GPU-based computational fluid dynamics (CFD) simulators on computing the drag coefficient. When tested on new combinations of geometries and boundary conditions (inlet velocities), GINO obtains a one-fourth reduction in error rate compared to deep neural network approaches.

Applications/Computer Vision

Liunian Li, Zi-Yi Dou, Nanyun Peng, Kai-Wei Chang

Recent development in vision-language approaches has instigated a paradigm shift in learning visual recognition models from language supervision. These approaches align objects with language queries (e.g. "a photo of a cat") and thus improve the models' adaptability to novel objects and domains. Recent studies have attempted to query these models with complex language expressions that include specifications of fine-grained details, such as colors, shapes, and relations. However, simply incorporating language descriptions into queries does not guarantee accurate interpretation by the models. In fact, our experiments show that GLIP, a state-of-the-art vision-language model for object detection, often disregards contextual information in the language descriptions and instead relies heavily on detecting objects solely by their names. To tackle the challenge, we propose a new description-conditioned (DesCo) paradigm of learning object recognition models with rich language descriptions consisting of two innovations: 1) we employ a large language model as a commonsense knowledge engine to generate rich language descriptions of objects; 2) we design context-sensitive queries to improve the model's ability in deciphering intricate nuances embedded within descriptions and enforce the model to focus on context rather than object names alone. On two novel object detection benchmarks, LVIS and OminiLabel, under the zero-shot detection setting, our approach achieves 34.8 APr minival (+9.1) and 29.3 AP (+3.6), respectively, surpassing the prior state-of-the-art models, GLIP and FIBER, by a large margin.

Deep Learning/Graph Neural Networks

Yixin Liu, Kaize Ding, Qinghua Lu, Fuyi Li, Leo Yu Zhang, Shirui Pan

Graph-level anomaly detection (GLAD) aims to identify graphs that exhibit notable dissimilarity compared to the majority in a collection. However, current works primarily focus on evaluating graph-level abnormality while failing to provide meaningful explanations for the predictions, which largely limits their reliability and application scope. In this paper, we investigate a new challenging problem, explainable GLAD, where the learning objective is to predict the abnormality of each graph sample with corresponding explanations, i.e., the vital subgraph that leads to the predictions. To address this challenging problem, we propose a Self-Interpretable Graph aNomaly dETection model (SIGNET for short) that detects anomalous graphs as well as generates informative explanations simultaneously. Specifically, we first introduce the multi-view subgraph information bottleneck (MSIB) framework, serving as the design basis of our self-interpretable GLAD approach. This way SIGNET is able to not only measure the abnormality of each graph based on cross-view mutual information but also provide informative graph rationales by extracting bottleneck subgraphs from the input graph and its dual hypergraph in a self-supervised way. Extensive experiments on 16 datasets demonstrate the anomaly detection capability and self-interpretability of SIGNET.

Applications/Language, Speech and Dialog

Noah Hollmann, Samuel Müller, Frank Hutter

As the field of automated machine learning (AutoML) advances, it becomes increasingly important to incorporate domain knowledge into these systems.We present an approach for doing so by harnessing the power of large language models (LLMs). Specifically, we introduce Context-Aware Automated Feature Engineering (CAAFE), a feature engineering method for tabular datasets that utilizes an LLM to iteratively generate additional semantically meaningful features for tabular datasets based on the description of the dataset. The method produces both Python code for creating new features and explanations for the utility of the generated features.Despite being methodologically simple, CAAFE improves performance on 11 out of 14 datasets -- boosting mean ROC AUC performance from 0.798 to 0.822 across all dataset - similar to the improvement achieved by using a random forest instead of logistic regression on our datasets. Furthermore, CAAFE is interpretable by providing a textual explanation for each generated feature.CAAFE paves the way for more extensive semi-automation in data science tasks and emphasizes the significance of context-aware solutions that can extend the scope of AutoML systems to semantic AutoML. We release our [code](url{https://github.com/automl/CAAFE), a simple [demo](url{https://colab.research.google.com/drive/1mCA8xOAJZ4MaB_alZvyARTMjhl6RZf0a) and a [python package](url{https://pypi.org/project/caafe/).

Social Aspects/Fairness, Equity, Justice and Safety

Junghyun Lee, Hanseul Cho, Se-Young Yun, Chulhee Yun

Fair Principal Component Analysis (PCA) is a problem setting where we aim to perform PCA while making the resulting representation fair in that the projected distributions, conditional on the sensitive attributes, match one another. However, existing approaches to fair PCA have two main problems: theoretically, there has been no statistical foundation of fair PCA in terms of learnability; practically, limited memory prevents us from using existing approaches, as they explicitly rely on full access to the entire data. On the theoretical side, we rigorously formulate fair PCA using a new notion called probably approximately fair and optimal (PAFO) learnability. On the practical side, motivated by recent advances in streaming algorithms for addressing memory limitation, we propose a new setting called fair streaming PCA along with a memory-efficient algorithm, fair noisy power method (FNPM). We then provide its statistical guarantee in terms of PAFO-learnability, which is the first of its kind in fair PCA literature. We verify our algorithm in the CelebA dataset without any pre-processing; while the existing approaches are inapplicable due to memory limitations, by turning it into a streaming setting, we show that our algorithm performs fair PCA efficiently and effectively.