ICML 2024 论文列表

Predictor-based methods have substantially enhanced Neural Architecture Search (NAS) optimization. The efficacy of these predictors is largely influenced by the method of encoding neural network architectures. While traditional encodings used an adjacency matrix describing the graph structure of a neural network, novel encodings embrace a variety of approaches from unsupervised pretraining of latent representations to vectors of zero-cost proxies. In this paper, we categorize and investigate neural encodings from three main types: structural, learned, and score-based. Furthermore, we extend these encodings and introduce *unified encodings*, that extend NAS predictors to multiple search spaces. Our analysis draws from experiments conducted on over 1.5 million neural network architectures on NAS spaces such as NASBench-101 (NB101), NB201, NB301, Network Design Spaces (NDS), and TransNASBench-101. Building on our study, we present our predictor **FLAN**: **Fl**ow **A**ttention for **N**AS. FLAN integrates critical insights on predictor design, transfer learning, and *unified encodings* to enable more than an order of magnitude cost reduction for training NAS accuracy predictors. Our implementation and encodings for all neural networks are open-sourced at https://github.com/abdelfattah-lab/flan_nas.

In this paper, we unveil that Language Models (LMs) can acquire new capabilities by assimilating parameters from homologous models without retraining or GPUs. We first introduce DARE to set most delta parameters (i.e., the disparity between fine-tuned and pre-trained parameters) to zeros without affecting the abilities of Supervised Fine-Tuning (SFT) LMs, which randomly **D**rops delta parameters with a ratio $p$ **A**nd **RE**scales the remaining ones by $1 / (1 - p)$ to approximate the original embeddings. Then, we use DARE as a versatile plug-in to sparsify delta parameters of multiple SFT homologous models for mitigating parameter interference and merge them into a single model by parameter fusing. We experiment with encoder- and decoder-based LMs, showing that: (1) SFT delta parameter value ranges are typically small (within 0.002) with extreme redundancy, and DARE can effortlessly eliminate 90% or even 99% of them; (2) DARE can merge multiple task-specific LMs into one LM with diverse capabilities. Notably, this phenomenon is more pronounced in large-scale LMs, where the merged LM reveals the potential to surpass the performance of any source LM, providing a new discovery. We also utilize DARE to create a merged LM that ranks first among models with 7 billion parameters on the Open LLM Leaderboard.

AI Uncertainty Quantification (UQ) has the potential to improve human decision-making beyond AI predictions alone by providing additional probabilistic information to users. The majority of past research on AI and human decision-making has concentrated on model explainability and interpretability, with little focus on understanding the potential impact of UQ on human decision-making. We evaluated the impact on human decision-making for instance-level UQ, calibrated using a strict scoring rule, in two online behavioral experiments. In the first experiment, our results showed that UQ was beneficial for decision-making performance compared to only AI predictions. In the second experiment, we found UQ had generalizable benefits for decision-making across a variety of representations for probabilistic information. These results indicate that implementing high quality, instance-level UQ for AI may improve decision-making with real systems compared to AI predictions alone.

In traditional federated learning, a single global model cannot perform equally well for all clients. Therefore, the need to achieve the *client-level fairness* in federated system has been emphasized, which can be realized by modifying the static aggregation scheme for updating the global model to an adaptive one, in response to the local signals of the participating clients. Our work reveals that existing fairness-aware aggregation strategies can be unified into an online convex optimization framework, in other words, a central server's *sequential decision making* process. To enhance the decision making capability, we propose simple and intuitive improvements for suboptimal designs within existing methods, presenting $\texttt{AAggFF}$. Considering practical requirements, we further subdivide our method tailored for the *cross-device* and the *cross-silo* settings, respectively. Theoretical analyses guarantee sublinear regret upper bounds for both settings: $\mathcal{O}(\sqrt{T \log{K}})$ for the cross-device setting, and $\mathcal{O}(K \log{T})$ for the cross-silo setting, with $K$ clients and $T$ federation rounds. Extensive experiments demonstrate that the federated system equipped with $\texttt{AAggFF}$ achieves better degree of client-level fairness than existing methods in both practical settings.

This paper presents an efficient and scalable incomplete multi-view clustering method, referred to as Enhanced Dictionary-Induced tenSorized incomplete multi-view clustering with Gaussian errOr raNk minimization (EDISON). Specifically, EDISON employs an enhanced dictionary representation strategy as the foundation for inferring missing data and constructing anchor graphs, ensuring robustness to less-than-ideal data and maintaining high computational efficiency. Additionally, we introduce Gaussian error rank as a concise approximation of the true tensor rank, facilitating a comprehensive exploration of the diverse information encapsulated by various singular values in tensor data. Additionally, we integrate a hyper-anchor graph Laplacian manifold regularization into the tensor representation, allowing for the simultaneous utilization of inter-view high-order correlations and intra-view local correlations. Extensive experiments demonstrate the superiority of the EDISON model in both effectiveness and efficiency compared to SOTA methods.

Fast convolution algorithms, including Winograd and FFT, can efficiently accelerate convolution operations in deep models. However, these algorithms depend on high-precision arithmetic to maintain inference accuracy, which conflicts with the model quantization. To resolve this conflict and further improve the efficiency of quantized convolution, we proposes SFC, a new algebra transform for fast convolution by extending the Discrete Fourier Transform (DFT) with symbolic computing, in which only additions are required to perform the transformation at specific transform points, avoiding the calculation of irrational number and reducing the requirement for precision. Additionally, we enhance convolution efficiency by introducing correction terms to convert invalid circular convolution outputs of the Fourier method into effective ones. The numerical error analysis is presented for the first time in this type of work and proves that our algorithms can provide a 3.68× multiplication reduction for 3×3 convolution, while the Winograd algorithm only achieves a 2.25× reduction with similarly low numerical errors. Experiments carried out on benchmarks and FPGA show that our new algorithms can further improve the computation efficiency of quantized models while maintaining accuracy, surpassing both the quantization-alone method and existing works on fast convolution quantization.

We investigate the generalization error of statistical learning models in a Federated Learning (FL) setting. Specifically, we study the evolution of the generalization error with the number of communication rounds $R$ between $K$ clients and a parameter server (PS), i.e. the effect on the generalization error of how often the clients' local models are aggregated at PS. In our setup, the more the clients communicate with PS the less data they use for local training in each round, such that the amount of training data per client is identical for distinct values of $R$. We establish PAC-Bayes and rate-distortion theoretic bounds on the generalization error that account explicitly for the effect of the number of rounds $R$, in addition to the number of participating devices $K$ and individual datasets size $n$. The bounds, which apply to a large class of loss functions and learning algorithms, appear to be the first of their kind for the FL setting. Furthermore, we apply our bounds to FL-type Support Vector Machines (FSVM); and derive (more) explicit bounds in this case. In particular, we show that the generalization bound of FSVM increases with $R$, suggesting that more frequent communication with PS diminishes the generalization power. This implies that the population risk decreases less fast with $R$ than does the empirical risk. Moreover, our bound suggests that the generalization error of FSVM decreases faster than that of centralized learning by a factor of $\mathcal{O}(\sqrt{\log(K)/K})$. Finally, we provide experimental results obtained using neural networks (ResNet-56) which show evidence that not only may our observations for FSVM hold more generally but also that the population risk may even start to increase beyond some value of $R$.

Multi-agent interactions between Large Language Model (LLM) agents have shown major improvements on diverse reasoning tasks. However, these involve long generations from multiple models across several rounds, making them expensive. Moreover, these multi-agent approaches fail to provide a final, single model for efficient inference. To address this, we introduce MAGDi, a new method for structured distillation of the reasoning interactions between multiple LLMs into smaller LMs. MAGDi teaches smaller models by representing multi-agent interactions as graphs, augmenting a base student model with a graph encoder, and distilling knowledge using three objective functions: next-token prediction, a contrastive loss between correct and incorrect reasoning, and a graph-based objective to model the interaction structure. Experiments on seven widely used commonsense and math reasoning benchmarks show that MAGDi improves the reasoning capabilities of smaller models, outperforming several methods that distill from a single teacher and multiple teachers. Moreover, MAGDi also demonstrates an order of magnitude higher efficiency over its teachers. We conduct extensive analyses to show that MAGDi (1) enhances the generalizability to out-of-domain tasks, (2) scales positively with the size and strength of the base student model, and (3) obtains larger improvements (via our multi-teacher training) when applying self-consistency – an inference technique that relies on model diversity.

Machine learning models fail catastrophically under distribution shift, but a surprisingly effective way to empirically improve robustness to some types of shift (*e.g.*, Imagenet-A/C) is to use stronger open-vocabulary classifiers derived from foundation models. In this work, we first note that for shifts governed by spurious correlations (features spuriously correlated with the label on the training data, but not on test), the zero-shot and few-shot performance of foundation models is no better than ERM models, and remains unchanged when pretrained data/model size is scaled. Secondly, even in these situations, foundation models are quite accurate at predicting the value of the spurious feature. In a simplified setup, we theoretically analyze both these findings. Specifically, we show that during contrastive pretraining, the simplicity bias of foundation models tends to result in the learning of features that mostly rely on the spurious attribute, compared to more robust features. We leverage these observations to propose Prompting for Robustness (PfR) which first uses foundation models to zero-shot predict the spurious attribute on labeled examples, and then learns a classifier with balanced performance across different groups of labels and spurious attribute. Across 5 vision and language tasks, we show that PfR's performance nearly equals that of an oracle algorithm (group DRO) that leverages human labeled spurious attributes.

Monte Carlo methods, Variational Inference, and their combinations play a pivotal role in sampling from intractable probability distributions. However, current studies lack a unified evaluation framework, relying on disparate performance measures and limited method comparisons across diverse tasks, complicating the assessment of progress and hindering the decision-making of practitioners. In response to these challenges, our work introduces a benchmark that evaluates sampling methods using a standardized task suite and a broad range of performance criteria. Moreover, we study existing metrics for quantifying mode collapse and introduce novel metrics for this purpose. Our findings provide insights into strengths and weaknesses of existing sampling methods, serving as a valuable reference for future developments.

Bayesian optimization has been successfully applied to optimize black-box functions where the number of evaluations is severely limited. However, in many real-world applications, it is hard or impossible to know in advance which designs are feasible due to some physical or system limitations. These issues lead to an even more challenging problem of optimizing an unknown function with unknown constraints. In this paper, we observe that in such scenarios optimal solution typically lies on the boundary between feasible and infeasible regions of the design space, making it considerably more difficult than that with interior optima. Inspired by this observation, we propose BE-CBO, a new Bayesian optimization method that efficiently explores the boundary between feasible and infeasible designs. To identify the boundary, we learn the constraints with an ensemble of neural networks that outperform the standard Gaussian Processes for capturing complex boundaries. Our method demonstrates superior performance against state-of-the-art methods through comprehensive experiments on synthetic and real-world benchmarks. Code available at: https://github.com/yunshengtian/BE-CBO

Predictions over graphs play a crucial role in various domains, including social networks and medicine. Graph Neural Networks (GNNs) have emerged as the dominant approach for learning on graph data. Although a graph-structure is provided as input to the GNN, in some cases the best solution can be obtained by ignoring it. While GNNs have the ability to ignore the graph-structure in such cases, it is not clear that they will. In this work, we show that GNNs actually tend to overfit the given graph-structure in the sense that they use it even when a better solution can be obtained by ignoring it. We analyze the implicit bias of gradient-descent learning of GNNs and prove that when the ground truth function does not use the graphs, GNNs are not guaranteed to learn a solution that ignores the graph, even with infinite data. We examine this phenomenon with respect to different graph distributions and find that regular graphs are more robust to this overfitting. We also prove that within the family of regular graphs, GNNs are guaranteed to extrapolate when learning with gradient descent. Finally, based on our empirical and theoretical findings, we demonstrate on real-data how regular graphs can be leveraged to reduce graph overfitting and enhance performance.

Large Language Models (LLMs), with their remarkable ability to tackle challenging and unseen reasoning problems, hold immense potential for tabular learning, that is vital for many real-world applications. In this paper, we propose a novel in-context learning framework, FeatLLM, which employs LLMs as feature engineers to produce an input data set that is optimally suited for tabular predictions. The generated features are used to infer class likelihood with a simple downstream machine learning model, such as linear regression and yields high performance few-shot learning. The proposed FeatLLM framework only uses this simple predictive model with the discovered features at inference time. Compared to existing LLM-based approaches, FeatLLM eliminates the need to send queries to the LLM for each sample at inference time. Moreover, it merely requires API-level access to LLMs, and overcomes prompt size limitations. As demonstrated across numerous tabular datasets from a wide range of domains, FeatLLM generates high-quality rules, significantly (10% on average) outperforming alternatives such as TabLLM and STUNT.

Optimization problems with access to only zeroth-order information of the objective function on Riemannian manifolds arise in various applications, spanning from statistical learning to robot learning. While various zeroth-order algorithms have been proposed in Euclidean space, they are not inherently designed to handle the challenging constraints imposed by Riemannian manifolds. The proper adaptation of zeroth-order techniques to Riemannian manifolds remained unknown until the pioneering work of (Li et al., 2023a). However, zeroth-order algorithms are widely observed to converge slowly and be unstable in practice. To alleviate these issues, we propose a Riemannian accelerated zeroth-order algorithm with improved robustness. Regarding efficiency, our accelerated algorithm has the function query complexity of $\mathcal{O}(\epsilon^{-7/4}d)$ for finding an $\epsilon$-approximate first-order stationary point. By introducing a small perturbation, it exhibits a function query complexity of $\tilde{\mathcal{O}}(\epsilon^{-7/4}d)$ for seeking a second-order stationary point with a high probability, matching state-of-the-art result in Euclidean space. Moreover, we further establish the almost sure convergence in the asymptotic sense through the Stable Manifold Theorem. Regarding robustness, our algorithm requires larger smoothing parameters in the order of $\tilde{\mathcal{O}}(\epsilon^{7/8}d^{-1/2})$, improving the existing result by a factor of $\tilde{\mathcal{O}}(\epsilon^{3/4})$.

In this paper, we focus on learning a linear time-invariant (LTI) model with low-dimensional latent variables but high-dimensional observations. We provide an algorithm that recovers the high-dimensional features, i.e. column space of the observer, embeds the data into low dimensions and learns the low-dimensional model parameters. Our algorithm enjoys a sample complexity guarantee of order $\tilde{\mathcal{O}}(n/\epsilon^2)$, where $n$ is the observation dimension. We further establish a fundamental lower bound indicating this complexity bound is optimal up to logarithmic factors and dimension-independent constants. We show that this inevitable linear factor of $n$ is due to the learning error of the observer's column space in the presence of high-dimensional noises. Extending our results, we consider a meta-learning problem inspired by various real-world applications, where the observer column space can be collectively learned from datasets of multiple LTI systems. An end-to-end algorithm is then proposed, facilitating learning LTI systems from a meta-dataset which breaks the sample complexity lower bound in certain scenarios.

Existing research of video understanding still struggles to achieve in-depth comprehension and reasoning in complex videos, primarily due to the under-exploration of two key bottlenecks: fine-grained spatial-temporal perceptive understanding and cognitive-level video scene comprehension. This paper bridges the gap by presenting a novel solution. We first introduce a novel video Multimodal Large Language Model (MLLM), MotionEpic, which achieves fine-grained pixel-level spatial-temporal video grounding by integrating video spatial-temporal scene graph (STSG) representation. Building upon MotionEpic, we then develop a Video-of-Thought (VoT) reasoning framework. VoT inherits the Chain-of-Thought (CoT) core, breaking down a complex task into simpler and manageable sub-problems, and addressing them step-by-step from a low-level pixel perception to high-level cognitive interpretation. Extensive experiments across various complex video QA benchmarks demonstrate that our overall framework strikingly boosts existing state-of-the-art. To our knowledge, this is the first attempt at successfully implementing the CoT technique for achieving human-level video reasoning, where we show great potential in extending it to a wider range of video understanding scenarios. Systems and codes will be open later.

In computer vision, keypoint detection is a fundamental task, with applications spanning from robotics to image retrieval; however, existing learning-based methods suffer from scale dependency, and lack flexibility. This paper introduces a novel approach that leverages Morse theory and persistent homology, powerful tools rooted in algebraic topology. We propose a novel loss function based on the recent introduction of a notion of subgradient in persistent homology, paving the way towards topological learning. Our detector, MorseDet, is the first topology-based learning model for feature detection, which achieves competitive performance in keypoint repeatability and introduces a principled and theoretically robust approach to the problem.

In-memory computing (IMC) has emerged as a promising solution to address both computation and data-movement challenges, by performing computation on data in-place directly in the memory array. IMC typically relies on analog operation, which makes analog-to-digital converters (ADCs) necessary, for converting results back to the digital domain. However, ADCs maintain computational efficiency by having limited precision, leading to substantial quantization errors in compute outputs. This work proposes RAOQ (Reshape and Adapt for Output Quantization) to overcome this issue, which comprises two classes of mechanisms including: 1) mitigating ADC quantization error by adjusting the statistics of activations and weights, through an activation-shifting approach (A-shift) and a weight reshaping technique (W-reshape); 2) adapting AI models to better tolerate ADC quantization through a bit augmentation method (BitAug), complemented by the introduction of ADC-LoRA, a low-rank approximation technique, to reduce the training overhead. RAOQ demonstrates consistently high performance across different scales and domains of neural network models for computer vision and natural language processing (NLP) tasks at various bit precisions, achieving state-of-the-art results with practical IMC implementations.

Fine-tuning the learnable prompt for a pre-trained vision-language model (VLM), such as CLIP, has demonstrated exceptional efficiency in adapting to a broad range of downstream tasks. Existing prompt tuning methods for VLMs do not distinguish spurious features introduced by biased training data from invariant features, and employ a uniform alignment process when adapting to unseen target domains. This can impair the cross-modal feature alignment when the testing data significantly deviate from the distribution of the training data, resulting in a poor out-of-distribution (OOD) generalization performance. In this paper, we reveal that the prompt tuning failure in such OOD scenarios can be attribute to the undesired alignment between the textual and the spurious feature. As a solution, we propose **CoOPood**, a fine-grained prompt tuning method that can discern the causal features and deliberately align the text modality with the invariant feature. Specifically, we design two independent contrastive phases using two lightweight projection layers during the alignment, each with different objectives: 1) pulling the text embedding closer to invariant image embedding and 2) pushing text embedding away from spurious image embedding. We have illustrated that **CoOPood** can serve as a general framework for VLMs and can be seamlessly integrated with existing prompt tuning methods. Extensive experiments on various OOD datasets demonstrate the performance superiority over state-of-the-art methods.