NeurIPS 2023 论文列表

Table Representation Learning (TRL) models are commonly pre-trained on large open-domain datasets comprising millions of tables and then used to address downstream tasks. Choosing the right TRL model to use on proprietary data can be challenging, as the best results depend on the content domain, schema, and data quality. Our purpose is to support end-users in testing TRL models on proprietary data in two established SQL-centric tasks, i.e., Question Answering (QA) and Semantic Parsing (SP). We present QATCH (Query-Aided TRL Checklist), a toolbox to highlight TRL models’ strengths and weaknesses on relational tables unseen at training time. For an input table, QATCH automatically generates a testing checklist tailored to QA and SP. Checklist generation is driven by a SQL query engine that crafts tests of different complexity. This design facilitates inherent portability, allowing the checks to be used by alternative models. We also introduce a set of cross-task performance metrics evaluating the TRL model’s performance over its output. Finally, we show how QATCH automatically generates tests for proprietary datasets to evaluate various state-of-the-art models including TAPAS, TAPEX, and CHATGPT.

Semantic segmentation has witnessed tremendous progress due to the proposal of various advanced network architectures. However, they are extremely hungry for delicate annotations to train, and the acquisition is laborious and unaffordable. Therefore, we present FreeMask in this work, which resorts to synthetic images from generative models to ease the burden of both data collection and annotation procedures. Concretely, we first synthesize abundant training images conditioned on the semantic masks provided by realistic datasets. This yields extra well-aligned image-mask training pairs for semantic segmentation models. We surprisingly observe that, solely trained with synthetic images, we already achieve comparable performance with real ones (e.g., 48.3 vs. 48.5 mIoU on ADE20K, and 49.3 vs. 50.5 on COCO-Stuff). Then, we investigate the role of synthetic images by joint training with real images, or pre-training for real images. Meantime, we design a robust filtering principle to suppress incorrectly synthesized regions. In addition, we propose to inequally treat different semantic masks to prioritize those harder ones and sample more corresponding synthetic images for them. As a result, either jointly trained or pre-trained with our filtered and re-sampled synthesized images, segmentation models can be greatly enhanced, e.g., from 48.7 to 52.0 on ADE20K.

We present the first framework to solve linear inverse problems leveraging pre-trained \textit{latent} diffusion models. Previously proposed algorithms (such as DPS and DDRM) only apply to \textit{pixel-space} diffusion models. We theoretically analyze our algorithm showing provable sample recovery in a linear model setting. The algorithmic insight obtained from our analysis extends to more general settings often considered in practice. Experimentally, we outperform previously proposed posterior sampling algorithms in a wide variety of problems including random inpainting, block inpainting, denoising, deblurring, destriping, and super-resolution.

Standard diffusion models involve an image transform -- adding Gaussian noise -- and an image restoration operator that inverts this degradation. We observe that the generative behavior of diffusion models is not strongly dependent on the choice of image degradation, and in fact, an entire family of generative models can be constructed by varying this choice. Even when using completely deterministic degradations (e.g., blur, masking, and more), the training and test-time update rules that underlie diffusion models can be easily generalized to create generative models. The success of these fully deterministic models calls into question the community's understanding of diffusion models, which relies on noise in either gradient Langevin dynamics or variational inference and paves the way for generalized diffusion models that invert arbitrary processes.

Deep learning methods have achieved state-of-the-art performance in most modeling tasks involving images, text and audio, however, they typically underperform tree-based methods on tabular data. In this paper, we hypothesize that a significant contributor to this performance gap is the interaction between irregular target functions resulting from the heterogeneous nature of tabular feature spaces, and the well-known tendency of neural networks to learn smooth functions. Utilizing tools from spectral analysis, we show that functions described by tabular datasets often have high irregularity, and that they can be smoothed by transformations such as scaling and ranking in order to improve performance. However, because these transformations tend to lose information or negatively impact the loss landscape during optimization, they need to be rigorously fine-tuned for each feature to achieve performance gains. To address these problems, we propose introducing frequency reduction as an inductive bias. We realize this bias as a neural network layer that promotes learning low-frequency representations of the input features, allowing the network to operate in a space where the target function is more regular. Our proposed method introduces less computational complexity than a fully connected layer, while significantly improving neural network performance, and speeding up its convergence on 14 tabular datasets.

The adversarial vulnerability of deep neural networks (DNNs) has drawn great attention due to the security risk of applying these models in real-world applications. Based on transferability of adversarial examples, an increasing number of transfer-based methods have been developed to fool black-box DNN models whose architecture and parameters are inaccessible. Although tremendous effort has been exerted, there still lacks a standardized benchmark that could be taken advantage of to compare these methods systematically, fairly, and practically. Our investigation shows that the evaluation of some methods needs to be more reasonable and more thorough to verify their effectiveness, to avoid, for example, unfair comparison and insufficient consideration of possible substitute/victim models. Therefore, we establish a transfer-based attack benchmark (TA-Bench) which implements 30+ methods. In this paper, we evaluate and compare them comprehensively on 10 popular substitute/victim models on ImageNet. New insights about the effectiveness of these methods are gained and guidelines for future evaluations are provided.

One of the most impactful findings in computational neuroscience over the past decade is that the object recognition accuracy of deep neural networks (DNNs) correlates with their ability to predict neural responses to natural images in the inferotemporal (IT) cortex. This discovery supported the long-held theory that object recognition is a core objective of the visual cortex, and suggested that more accurate DNNs would serve as better models of IT neuron responses to images. Since then, deep learning has undergone a revolution of scale: billion parameter-scale DNNs trained on billions of images are rivaling or outperforming humans at visual tasks including object recognition. Have today's DNNs become more accurate at predicting IT neuron responses to images as they have grown more accurate at object recognition? Surprisingly, across three independent experiments, we find that this is not the case. DNNs have become progressively worse models of IT as their accuracy has increased on ImageNet. To understand why DNNs experience this trade-off and evaluate if they are still an appropriate paradigm for modeling the visual system, we turn to recordings of IT that capture spatially resolved maps of neuronal activity elicited by natural images. These neuronal activity maps reveal that DNNs trained on ImageNet learn to rely on different visual features than those encoded by IT and that this problem worsens as their accuracy increases. We successfully resolved this issue with the neural harmonizer, a plug-and-play training routine for DNNs that aligns their learned representations with humans. Our results suggest that harmonized DNNs break the trade-off between ImageNet accuracy and neural prediction accuracy that assails current DNNs and offer a path to more accurate models of biological vision. Our work indicates that the standard approach for modeling IT with task-optimized DNNs needs revision, and other biological constraints, including human psychophysics data, are needed to accurately reverse-engineer the visual cortex.

Many real-world domains require safe decision making in uncertain environments. In this work, we introduce a deep reinforcement learning framework for approaching this important problem. We consider a distribution over transition models, and apply a risk-averse perspective towards model uncertainty through the use of coherent distortion risk measures. We provide robustness guarantees for this framework by showing it is equivalent to a specific class of distributionally robust safe reinforcement learning problems. Unlike existing approaches to robustness in deep reinforcement learning, however, our formulation does not involve minimax optimization. This leads to an efficient, model-free implementation of our approach that only requires standard data collection from a single training environment. In experiments on continuous control tasks with safety constraints, we demonstrate that our framework produces robust performance and safety at deployment time across a range of perturbed test environments.

AI alignment refers to models acting towards human-intended goals, preferences, or ethical principles. Analyzing the similarity between models and humans can be a proxy measure for ensuring AI safety. In this paper, we focus on the models' visual perception alignment with humans, further referred to as AI-human visual alignment. Specifically, we propose a new dataset for measuring AI-human visual alignment in terms of image classification. In order to evaluate AI-human visual alignment, a dataset should encompass samples with various scenarios and have gold human perception labels. Our dataset consists of three groups of samples, namely Must-Act (i.e., Must-Classify), Must-Abstain, and Uncertain, based on the quantity and clarity of visual information in an image and further divided into eight categories. All samples have a gold human perception label; even Uncertain (e.g., severely blurry) sample labels were obtained via crowd-sourcing. The validity of our dataset is verified by sampling theory, statistical theories related to survey design, and experts in the related fields. Using our dataset, we analyze the visual alignment and reliability of five popular visual perception models and seven abstention methods. Our code and data is available at https://github.com/jiyounglee-0523/VisAlign.

Recently, model-based reinforcement learning algorithms have demonstrated remarkable efficacy in visual input environments. These approaches begin by constructing a parameterized simulation world model of the real environment through self-supervised learning. By leveraging the imagination of the world model, the agent's policy is enhanced without the constraints of sampling from the real environment. The performance of these algorithms heavily relies on the sequence modeling and generation capabilities of the world model. However, constructing a perfectly accurate model of a complex unknown environment is nearly impossible. Discrepancies between the model and reality may cause the agent to pursue virtual goals, resulting in subpar performance in the real environment. Introducing random noise into model-based reinforcement learning has been proven beneficial. In this work, we introduce Stochastic Transformer-based wORld Model (STORM), an efficient world model architecture that combines the strong sequence modeling and generation capabilities of Transformers with the stochastic nature of variational autoencoders. STORM achieves a mean human performance of $126.7\%$ on the Atari $100$k benchmark, setting a new record among state-of-the-art methods that do not employ lookahead search techniques. Moreover, training an agent with $1.85$ hours of real-time interaction experience on a single NVIDIA GeForce RTX 3090 graphics card requires only $4.3$ hours, showcasing improved efficiency compared to previous methodologies.

Designing models that are both expressive and preserve known invariances of tasks is an increasingly hard problem. Existing solutions tradeoff invariance for computational or memory resources. In this work, we show how to leverage randomness and design models that are both expressive and invariant but use less resources. Inspired by randomized algorithms, our key insight is that accepting probabilistic notions of universal approximation and invariance can reduce our resource requirements. More specifically, we propose a class of binary classification models called Randomized Linear Classifiers (RLCs). We give parameter and sample size conditions in which RLCs can, with high probability, approximate any (smooth) function while preserving invariance to compact group transformations. Leveraging this result, we design three RLCs that are provably probabilistic invariant for classification tasks over sets, graphs, and spherical data. We show how these models can achieve probabilistic invariance and universality using less resources than (deterministic) neural networks and their invariant counterparts. Finally, we empirically demonstrate the benefits of this new class of models on invariant tasks where deterministic invariant neural networks are known to struggle.

This paper investigates methods for improving generative data augmentation for deep learning. Generative data augmentation leverages the synthetic samples produced by generative models as an additional dataset for classification with small dataset settings. A key challenge of generative data augmentation is that the synthetic data contain uninformative samples that degrade accuracy. This can be caused by the synthetic samples not perfectly representing class categories in real data and uniform sampling not necessarily providing useful samples for tasks. In this paper, we present a novel strategy for generative data augmentation called *meta generative regularization* (MGR). To avoid the degradation of generative data augmentation, MGR utilizes synthetic samples for regularizing feature extractors instead of training classifiers. These synthetic samples are dynamically determined to minimize the validation losses through meta-learning. We observed that MGR can avoid the performance degradation of naive generative data augmentation and boost the baselines. Experiments on six datasets showed that MGR is effective particularly when datasets are smaller and stably outperforms baselines by up to 7 percentage points on test accuracy.

Ensembles of machine learning models have been well established as a powerful method of improving performance over a single model. Traditionally, ensembling algorithms train their base learners independently or sequentially with the goal of optimizing their joint performance. In the case of deep ensembles of neural networks, we are provided with the opportunity to directly optimize the true objective: the joint performance of the ensemble as a whole. Surprisingly, however, directly minimizing the loss of the ensemble appears to rarely be applied in practice. Instead, most previous research trains individual models independently with ensembling performed _post hoc_. In this work, we show that this is for good reason - _joint optimization of ensemble loss results in degenerate behavior_. We approach this problem by decomposing the ensemble objective into the strength of the base learners and the diversity between them. We discover that joint optimization results in a phenomenon in which base learners collude to artificially inflate their apparent diversity. This pseudo-diversity fails to generalize beyond the training data, causing a larger generalization gap. We proceed to comprehensively demonstrate the practical implications of this effect on a range of standard machine learning tasks and architectures by smoothly interpolating between independent training and joint optimization.

We consider the problem of contextual bandits and imitation learning, where the learner lacks direct knowledge of the executed action's reward. Instead, the learner can actively request the expert at each round to compare two actions and receive noisy preference feedback. The learner's objective is two-fold: to minimize regret associated with the executed actions, while simultaneously, minimizing the number of comparison queries made to the expert. In this paper, we assume that the learner has access to a function class that can represent the expert's preference model under appropriate link functions and present an algorithm that leverages an online regression oracle with respect to this function class. For the contextual bandit setting, our algorithm achieves a regret bound that combines the best of both worlds, scaling as $O(\min\\{\sqrt{T}, d/\Delta\\})$, where $T$ represents the number of interactions, $d$ represents the eluder dimension of the function class, and $\Delta$ represents the minimum preference of the optimal action over any suboptimal action under all contexts. Our algorithm does not require the knowledge of $\Delta$, and the obtained regret bound is comparable to what can be achieved in the standard contextual bandits setting where the learner observes reward signals at each round. Additionally, our algorithm makes only $O(\min\\{T, d^2/\Delta^2\\})$ queries to the expert. We then extend our algorithm to the imitation learning setting, where the agent engages with an unknown environment in episodes of length $H$, and provide similar guarantees regarding regret and query complexity. Interestingly, with preference-based feedback, our imitation learning algorithm can learn a policy outperforming a sub-optimal expert, matching the result from interactive imitation learning algorithms [Ross and Bagnell, 2014] that require access to the expert's actions and also reward signals.

Unlike most reinforcement learning agents which require an unrealistic amount of environment interactions to learn a new behaviour, humans excel at learning quickly by merely observing and imitating others. This ability highly depends on the fact that humans have a model of their own embodiment that allows them to infer the most likely actions that led to the observed behaviour. In this paper, we propose Action Inference by Maximising Evidence (AIME) to replicate this behaviour using world models. AIME consists of two distinct phases. In the first phase, the agent learns a world model from its past experience to understand its own body by maximising the ELBO. While in the second phase, the agent is given some observation-only demonstrations of an expert performing a novel task and tries to imitate the expert's behaviour. AIME achieves this by defining a policy as an inference model and maximising the evidence of the demonstration under the policy and world model. Our method is "zero-shot" in the sense that it does not require further training for the world model or online interactions with the environment after given the demonstration. We empirically validate the zero-shot imitation performance of our method on the Walker and Cheetah embodiment of the DeepMind Control Suite and find it outperforms the state-of-the-art baselines. Code is available at: https://github.com/argmax-ai/aime.

The aim of this paper is to improve the understanding of the optimization landscape for policy optimization problems in reinforcement learning. Specifically, we show that the superlevel set of the objective function with respect to the policy parameter is always a connected set both in the tabular setting and under policies represented by a class of neural networks. In addition, we show that the optimization objective as a function of the policy parameter and reward satisfies a stronger “equiconnectedness” property. To our best knowledge, these are novel and previously unknown discoveries. We present an application of the connectedness of these superlevel sets to the derivation of minimax theorems for robust reinforcement learning. We show that any minimax optimization program which is convex on one side and is equiconnected on the other side observes the minimax equality (i.e. has a Nash equilibrium). We find that this exact structure is exhibited by an interesting class of robust reinforcement learning problems under an adversarial reward attack, and the validity of its minimax equality immediately follows. This is the first time such a result is established in the literature.

While personalized recommendations systems have become increasingly popular, ensuring user data protection remains a top concern in the development of these learning systems. A common approach to enhancing privacy involves training models using anonymous data rather than individual data. In this paper, we explore a natural technique called "look-alike clustering", which involves replacing sensitive features of individuals with the cluster's average values. We provide a precise analysis of how training models using anonymous cluster centers affects their generalization capabilities. We focus on an asymptotic regime where the size of the training set grows in proportion to the features dimension. Our analysis is based on the Convex Gaussian Minimax Theorem (CGMT) and allows us to theoretically understand the role of different model components on the generalization error. In addition, we demonstrate that in certain high-dimensional regimes, training over anonymous cluster centers acts as a regularization and improves generalization error of the trained models. Finally, we corroborate our asymptotic theory with finite-sample numerical experiments where we observe a perfect match when the sample size is only of order of a few hundreds.

Automatic coding of International Classification of Diseases (ICD) is a multi-label text categorization task that involves extracting disease or procedure codes from clinical notes. Despite the application of state-of-the-art natural language processing (NLP) techniques, there are still challenges including limited availability of data due to privacy constraints and the high variability of clinical notes caused by different writing habits of medical professionals and various pathological features of patients. In this work, we investigate the semi-structured nature of clinical notes and propose an automatic algorithm to segment them into sections. To address the variability issues in existing ICD coding models with limited data, we introduce a contrastive pre-training approach on sections using a soft multi-label similarity metric based on tree edit distance. Additionally, we design a masked section training strategy to enable ICD coding models to locate sections related to ICD codes. Extensive experimental results demonstrate that our proposed training strategies effectively enhance the performance of existing ICD coding methods.

We consider a problem of learning a model from multiple sources with the goal to perform well on a new target distribution. Such problem arises in learning with data collected from multiple sources (e.g. crowdsourcing) or learning in distributed systems, where the data can be highly heterogeneous. The goal of learner is to mix these data sources in a target-distribution aware way and simultaneously minimize the empirical risk on the mixed source. The literature has made some tangible advancements in establishing theory of learning on mixture domain. However, there are still two unsolved problems. Firstly, how to estimate the optimal mixture of sources, given a target domain; Secondly, when there are numerous target domains, we have to solve empirical risk minimization for each target on possibly unique mixed source data , which is computationally expensive. In this paper we address both problems efficiently and with guarantees. We cast the first problem, mixture weight estimation as convex-nonconcave compositional minimax, and propose an efficient stochastic algorithm with provable stationarity guarantees. Next, for the second problem, we identify that for certain regime, solving ERM for each target domain individually can be avoided, and instead parameters for a target optimal model can be viewed as a non-linear function on a space of the mixture coefficients. To this end, we show that in offline setting, a GD-trained overparameterized neural network can provably learn such function. Finally, we also consider an online setting and propose an label efficient online algorithm, which predicts parameters for new models given arbitrary sequence of mixing coefficients, while enjoying optimal regret.