NeurIPS 2023 论文列表

Conditional independence (CI) testing is a fundamental task in statistics and machine learning, but its effectiveness is hindered by the challenges posed by high-dimensional conditioning variables and limited data samples. This article introduces a novel testing approach to address these challenges and enhance control of the type I error while achieving high power under alternative hypotheses. The proposed approach incorporates a computationally efficient classifier-based conditional mutual information (CMI) estimator, capable of capturing intricate dependence structures among variables. To approximate a distribution encoding the null hypothesis, a $k$-nearest-neighbor local sampling strategy is employed. An important advantage of this approach is its ability to operate without assumptions about distribution forms or feature dependencies. Furthermore, it eliminates the need to derive asymptotic null distributions for the estimated CMI and avoids dataset splitting, making it particularly suitable for small datasets. The method presented in this article demonstrates asymptotic control of the type I error and consistency against all alternative hypotheses. Extensive analyses using both synthetic and real data highlight the computational efficiency of the proposed test. Moreover, it outperforms existing state-of-the-art methods in terms of type I and II errors, even in scenarios with high-dimensional conditioning sets. Additionally, the proposed approach exhibits robustness in the presence of heavy-tailed data.

Unsupervised domain adaptation (UDA) is a pivotal form in machine learning to extend the in-domain model to the distinctive target domains where the data distributions differ. Most prior works focus on capturing the inter-domain transferability but largely overlook rich intra-domain structures, which empirically results in even worse discriminability. In this work, we introduce a novel graph SPectral Alignment (SPA) framework to tackle the tradeoff. The core of our method is briefly condensed as follows: (i)-by casting the DA problem to graph primitives, SPA composes a coarse graph alignment mechanism with a novel spectral regularizer towards aligning the domain graphs in eigenspaces; (ii)-we further develop a fine-grained message propagation module --- upon a novel neighbor-aware self-training mechanism --- in order for enhanced discriminability in the target domain. On standardized benchmarks, the extensive experiments of SPA demonstrate that its performance has surpassed the existing cutting-edge DA methods. Coupled with dense model analysis, we conclude that our approach indeed possesses superior efficacy, robustness, discriminability, and transferability. Code and data are available at: https://github.com/CrownX/SPA.

Prototype-based meta-learning has emerged as a powerful technique for addressing few-shot learning challenges. However, estimating a deterministic prototype using a simple average function from a limited number of examples remains a fragile process. To overcome this limitation, we introduce ProtoDiff, a novel framework that leverages a task-guided diffusion model during the meta-training phase to gradually generate prototypes, thereby providing efficient class representations. Specifically, a set of prototypes is optimized to achieve per-task prototype overfitting, enabling accurately obtaining the overfitted prototypes for individual tasks. Furthermore, we introduce a task-guided diffusion process within the prototype space, enabling the meta-learning of a generative process that transitions from a vanilla prototype to an overfitted prototype. ProtoDiff gradually generates task-specific prototypes from random noise during the meta-test stage, conditioned on the limited samples available for the new task. Furthermore, to expedite training and enhance ProtoDiff's performance, we propose the utilization of residual prototype learning, which leverages the sparsity of the residual prototype. We conduct thorough ablation studies to demonstrate its ability to accurately capture the underlying prototype distribution and enhance generalization. The new state-of-the-art performance on within-domain, cross-domain, and few-task few-shot classification further substantiates the benefit of ProtoDiff.

We present a new method that includes three key components of distributed optimization and federated learning: variance reduction of stochastic gradients, partial participation, and compressed communication. We prove that the new method has optimal oracle complexity and state-of-the-art communication complexity in the partial participation setting. Regardless of the communication compression feature, our method successfully combines variance reduction and partial participation: we get the optimal oracle complexity, never need the participation of all nodes, and do not require the bounded gradients (dissimilarity) assumption.

We study a general form of Smoothed Online Convex Optimization, a.k.a. SOCO, including multi-step switching costs and feedback delay. We propose a novel machine learning (ML) augmented online algorithm, Robustness-Constrained Learning (RCL), which combines untrusted ML predictions with a trusted expert online algorithm via constrained projection to robustify the ML prediction. Specifically, we prove that RCL is able to guarantee $(1+\lambda)$-competitiveness against any given expert for any $\lambda>0$, while also explicitly training the ML model in a robustification-aware manner to improve the average-case performance. Importantly, RCL is the first ML-augmented algorithm with a provable robustness guarantee in the case of multi-step switching cost and feedback delay. We demonstrate the improvement of RCL in both robustness and average performance using battery management as a case study.

Road traffic forecasting plays a critical role in smart city initiatives and has experienced significant advancements thanks to the power of deep learning in capturing non-linear patterns of traffic data. However, the promising results achieved on current public datasets may not be applicable to practical scenarios due to limitations within these datasets. First, the limited sizes of them may not reflect the real-world scale of traffic networks. Second, the temporal coverage of these datasets is typically short, posing hurdles in studying long-term patterns and acquiring sufficient samples for training deep models. Third, these datasets often lack adequate metadata for sensors, which compromises the reliability and interpretability of the data. To mitigate these limitations, we introduce the LargeST benchmark dataset. It encompasses a total number of 8,600 sensors in California with a 5-year time coverage and includes comprehensive metadata. Using LargeST, we perform in-depth data analysis to extract data insights, benchmark well-known baselines in terms of their performance and efficiency, and identify challenges as well as opportunities for future research. We release the datasets and baseline implementations at: https://github.com/liuxu77/LargeST.

In stochastic zeroth-order optimization, a problem of practical relevance is understanding how to fully exploit the local geometry of the underlying objective function. We consider a fundamental setting in which the objective function is quadratic, and provide the first tight characterization of the optimal Hessian-dependent sample complexity. Our contribution is twofold. First, from an information-theoretic point of view, we prove tight lower bounds on Hessian-dependent complexities by introducing a concept called \emph{energy allocation}, which captures the interaction between the searching algorithm and the geometry of objective functions. A matching upper bound is obtained by solving the optimal energy spectrum. Then, algorithmically, we show the existence of a Hessian-independent algorithm that universally achieves the asymptotic optimal sample complexities for all Hessian instances. The optimal sample complexities achieved by our algorithm remain valid for heavy-tailed noise distributions, which are enabled by a truncation method.

Reinforcement learning (RL) agents have long sought to approach the efficiency of human learning. Humans are great observers who can learn by aggregating external knowledge from various sources, including observations from others' policies of attempting a task. Prior studies in RL have incorporated external knowledge policies to help agents improve sample efficiency. However, it remains non-trivial to perform arbitrary combinations and replacements of those policies, an essential feature for generalization and transferability. In this work, we present Knowledge-Grounded RL (KGRL), an RL paradigm fusing multiple knowledge policies and aiming for human-like efficiency and flexibility. We propose a new actor architecture for KGRL, Knowledge-Inclusive Attention Network (KIAN), which allows free knowledge rearrangement due to embedding-based attentive action prediction. KIAN also addresses entropy imbalance, a problem arising in maximum entropy KGRL that hinders an agent from efficiently exploring the environment, through a new design of policy distributions. The experimental results demonstrate that KIAN outperforms alternative methods incorporating external knowledge policies and achieves efficient and flexible learning. Our implementation is available at https://github.com/Pascalson/KGRL.git .

We introduce a general method for achieving robust group-invariance in group-equivariant convolutional neural networks ($G$-CNNs), which we call the $G$-triple-correlation ($G$-TC) layer. The approach leverages the theory of the triple-correlation on groups, which is the unique, lowest-degree polynomial invariant map that is also \textit{complete}. Many commonly used invariant maps\textemdash such as the \texttt{max}\textemdash are incomplete: they remove both group and signal structure. A complete invariant, by contrast, removes only the variation due to the actions of the group, while preserving all information about the structure of the signal. The completeness of the triple correlation endows the $G$-TC layer with strong robustness, which can be observed in its resistance to invariance-based adversarial attacks. In addition, we observe that it yields measurable improvements in classification accuracy over standard Max $G$-Pooling in $G$-CNN architectures. We provide a general and efficient implementation of the method for any discretized group, which requires only a table defining the group's product structure. We demonstrate the benefits of this method for $G$-CNNs defined on both commutative and non-commutative groups\textemdash $SO(2)$, $O(2)$, $SO(3)$, and $O(3)$ (discretized as the cyclic $C8$, dihedral $D16$, chiral octahedral $O$ and full octahedral $O_h$ groups)\textemdash acting on $\mathbb{R}^2$ and $\mathbb{R}^3$ on both $G$-MNIST and $G$-ModelNet10 datasets.

We show that a simple single-pass semi-streaming variant of the Pivot algorithm for Correlation Clustering gives a (3+eps)-approximation using O(n/eps) words of memory. This is a slight improvement over the recent results of Cambus, Kuhn, Lindy, Pai, and Uitto, who gave a (3+eps)-approximation using O(n log n) words of memory, and Behnezhad, Charikar, Ma, and Tan, who gave a 5-approximation using O(n) words of memory. One of the main contributions of our paper is that the algorithm and its analysis are simple and easy to understand.

Self-supervised learning (SSL) algorithms can produce useful image representations by learning to associate different parts of natural images with one another. However, when taken to the extreme, SSL models can unintendedly memorize specific parts in individual training samples rather than learning semantically meaningful associations. In this work, we perform a systematic study of the unintended memorization of image-specific information in SSL models -- which we refer to as déjà vu memorization. Concretely, we show that given the trained model and a crop of a training image containing only the background (e.g., water, sky, grass), it is possible to infer the foreground object with high accuracy or even visually reconstruct it. Furthermore, we show that déjà vu memorization is common to different SSL algorithms, is exacerbated by certain design choices, and cannot be detected by conventional techniques for evaluating representation quality. Our study of déjà vu memorization reveals previously unknown privacy risks in SSL models, as well as suggests potential practical mitigation strategies.

Existing statistical learning guarantees for general kernel regressors often yield loose bounds when used with finite-rank kernels. Yet, finite-rank kernels naturally appear in a number of machine learning problems, e.g. when fine-tuning a pre-trained deep neural network's last layer to adapt it to a novel task when performing transfer learning. We address this gap for finite-rank kernel ridge regression (KRR) by deriving sharp non-asymptotic upper and lower bounds for the KRR test error of any finite-rank KRR. Our bounds are tighter than previously derived bounds on finite-rank KRR and, unlike comparable results, they also remain valid for any regularization parameters.

Time series anomaly detection is challenging due to the complexity and variety of patterns that can occur. One major difficulty arises from modeling time-dependent relationships to find contextual anomalies while maintaining detection accuracy for point anomalies. In this paper, we propose a framework for unsupervised time series anomaly detection that utilizes point-based and sequence-based reconstruction models. The point-based model attempts to quantify point anomalies, and the sequence-based model attempts to quantify both point and contextual anomalies. Under the formulation that the observed time point is a two-stage deviated value from a nominal time point, we introduce a nominality score calculated from the ratio of a combined value of the reconstruction errors. We derive an induced anomaly score by further integrating the nominality score and anomaly score, then theoretically prove the superiority of the induced anomaly score over the original anomaly score under certain conditions. Extensive studies conducted on several public datasets show that the proposed framework outperforms most state-of-the-art baselines for time series anomaly detection.

Neural sequence models based on the transformer architecture have demonstrated remarkable \emph{in-context learning} (ICL) abilities, where they can perform new tasks when prompted with training and test examples, without any parameter update to the model. This work first provides a comprehensive statistical theory for transformers to perform ICL. Concretely, we show that transformers can implement a broad class of standard machine learning algorithms in context, such as least squares, ridge regression, Lasso, learning generalized linear models, and gradient descent on two-layer neural networks, with near-optimal predictive power on various in-context data distributions. Using an efficient implementation of in-context gradient descent as the underlying mechanism, our transformer constructions admit mild size bounds, and can be learned with polynomially many pretraining sequences. Building on these ``base'' ICL algorithms, intriguingly, we show that transformers can implement more complex ICL procedures involving \emph{in-context algorithm selection}, akin to what a statistician can do in real life---A \emph{single} transformer can adaptively select different base ICL algorithms---or even perform qualitatively different tasks---on different input sequences, without any explicit prompting of the right algorithm or task. We both establish this in theory by explicit constructions, and also observe this phenomenon experimentally. In theory, we construct two general mechanisms for algorithm selection with concrete examples: pre-ICL testing, and post-ICL validation. As an example, we use the post-ICL validation mechanism to construct a transformer that can perform nearly Bayes-optimal ICL on a challenging task---noisy linear models with mixed noise levels. Experimentally, we demonstrate the strong in-context algorithm selection capabilities of standard transformer architectures.

Human communication has a multi-modal and multi-affection nature. The inter-relatedness of different emotions and sentiments poses a challenge to jointly detect multiple human affections with multi-modal clues. Recent advances in this field employed multi-task learning paradigms to render the inter-relatedness across tasks, but the scarcity of publicly available resources sets a limit to the potential of works. To fill this gap, we build the first Chinese Multi-modal Multi-Affection conversation (CMMA) dataset, which contains 3,000 multi-party conversations and 21,795 multi-modal utterances collected from various styles of TV-series. CMMA contains a wide variety of affection labels, including sentiment, emotion, sarcasm and humor, as well as the novel inter-correlations values between certain pairs of tasks. Moreover, it provides the topic and speaker information in conversations, which promotes better modeling of conversational context. On the dataset, we empirically analyze the influence of different data modalities and conversational contexts on different affection analysis tasks, and exhibit the practical benefit of inter-task correlations. The full dataset will be publicly available for research\footnote{https://github.com/annoymity2022/Chinese-Dataset}

The current state of re-identification (ReID) models poses limitations to their applicability in the open world, as they are primarily designed and trained for specific categories like person or vehicle. In light of the importance of ReID technology for tracking wildlife populations and migration patterns, we propose a new task called ``Re-identify Any Animal in the Wild'' (ReID-AW). This task aims to develop a ReID model capable of handling any unseen wildlife category it encounters. To address this challenge, we have created a comprehensive dataset called Wildlife-71, which includes ReID data from 71 different wildlife categories. This dataset is the first of its kind to encompass multiple object categories in the realm of ReID. Furthermore, we have developed a universal re-identification model named UniReID specifically for the ReID-AW task. To enhance the model's adaptability to the target category, we employ a dynamic prompting mechanism using category-specific visual prompts. These prompts are generated based on knowledge gained from a set of pre-selected images within the target category. Additionally, we leverage explicit semantic knowledge derived from the large-scale pre-trained language model, GPT-4. This allows UniReID to focus on regions that are particularly useful for distinguishing individuals within the target category. Extensive experiments have demonstrated the remarkable generalization capability of our UniReID model. It showcases promising performance in handling arbitrary wildlife categories, offering significant advancements in the field of ReID for wildlife conservation and research purposes.

Text-to-image diffusion models have made significant advances in generating and editing high-quality images. As a result, numerous approaches have explored the ability of diffusion model features to understand and process single images for downstream tasks, e.g., classification, semantic segmentation, and stylization. However, significantly less is known about what these features reveal across multiple, different images and objects. In this work, we exploit Stable Diffusion (SD) features for semantic and dense correspondence and discover that with simple post-processing, SD features can perform quantitatively similar to SOTA representations. Interestingly, the qualitative analysis reveals that SD features have very different properties compared to existing representation learning features, such as the recently released DINOv2: while DINOv2 provides sparse but accurate matches, SD features provide high-quality spatial information but sometimes inaccurate semantic matches. We demonstrate that a simple fusion of these two features works surprisingly well, and a zero-shot evaluation using nearest neighbors on these fused features provides a significant performance gain over state-of-the-art methods on benchmark datasets, e.g., SPair-71k, PF-Pascal, and TSS. We also show that these correspondences can enable interesting applications such as instance swapping in two images. Project page: https://sd-complements-dino.github.io/.

The dominant paradigm in 3D human pose estimation that lifts a 2D pose sequence to 3D heavily relies on long-term temporal clues (i.e., using a daunting number of video frames) for improved accuracy, which incurs performance saturation, intractable computation and the non-causal problem. This can be attributed to their inherent inability to perceive spatial context as plain 2D joint coordinates carry no visual cues. To address this issue, we propose a straightforward yet powerful solution: leveraging the $\textit{readily available}$ intermediate visual representations produced by off-the-shelf (pre-trained) 2D pose detectors -- no finetuning on the 3D task is even needed. The key observation is that, while the pose detector learns to localize 2D joints, such representations (e.g., feature maps) implicitly encode the joint-centric spatial context thanks to the regional operations in backbone networks. We design a simple baseline named $\textbf{Context-Aware PoseFormer}$ to showcase its effectiveness. $\textit{Without access to any temporal information}$, the proposed method significantly outperforms its context-agnostic counterpart, PoseFormer, and other state-of-the-art methods using up to $\textit{hundreds of}$ video frames regarding both speed and precision. $\textit{Project page:}$ https://qitaozhao.github.io/ContextAware-PoseFormer

With direct access to human-written reference as memory, retrieval-augmented generation has achieved much progress in a wide range of text generation tasks. Since better memory would typically prompt better generation (we define this as primal problem). The traditional approach for memory retrieval involves selecting memory that exhibits the highest similarity to the input. However, this method is constrained by the quality of the fixed corpus from which memory is retrieved. In this paper, by exploring the duality of the primal problem: better generation also prompts better memory, we propose a novel framework, selfmem, which addresses this limitation by iteratively employing a retrieval-augmented generator to create an unbounded memory pool and using a memory selector to choose one output as memory for the subsequent generation round. This enables the model to leverage its own output, referred to as self-memory, for improved generation. We evaluate the effectiveness of selfmem on three distinct text generation tasks: neural machine translation, abstractive text summarization, and dialogue generation, under two generation paradigms: fine-tuned small model and few-shot LLM. Our approach achieves state-of-the-art results in four directions in JRC-Acquis translation dataset, 50.3 ROUGE-1 in XSum, and 62.9 ROUGE-1 in BigPatent, demonstrating the potential of self-memory in enhancing retrieval-augmented generation models. Furthermore, we conduct thorough analyses of each component in the selfmem framework to identify current system bottlenecks and provide insights for future research.