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Optimization · Large Scale, Parallel and Distributed

Wenzhi Fang, Dong-Jun Han, Evan Chen, Shiqiang Wang, Christopher Brinton

While traditional federated learning (FL) typically focuses on a star topology where clients are directly connected to a central server, real-world distributed systems often exhibit hierarchical architectures. Hierarchical FL (HFL) has emerged as a promising solution to bridge this gap, leveraging aggregation points at multiple levels of the system. However, existing algorithms for HFL encounter challenges in dealing with multi-timescale model drift, i.e., model drift occurring across hierarchical levels of data heterogeneity. In this paper, we propose a multi-timescale gradient correction (MTGC) methodology to resolve this issue. Our key idea is to introduce distinct control variables to (i) correct the client gradient towards the group gradient, i.e., to reduce client model drift caused by local updates based on individual datasets, and (ii) correct the group gradient towards the global gradient, i.e., to reduce group model drift caused by FL over clients within the group. We analytically characterize the convergence behavior of MTGC under general non-convex settings, overcoming challenges associated with couplings between correction terms. We show that our convergence bound is immune to the extent of data heterogeneity, confirming the stability of the proposed algorithm against multi-level non-i.i.d. data. Through extensive experiments on various datasets and models, we validate the effectiveness of MTGC in diverse HFL settings. The code for this project is available at https://github.com/wenzhifang/MTGC.

Graph Neural Networks

Aref Einizade, Fragkiskos Malliaros, Jhony H. Giraldo

Processing multidomain data defined on multiple graphs holds significant potential in various practical applications in computer science. However, current methods are mostly limited to discrete graph filtering operations. Tensorial partial differential equations on graphs (TPDEGs) provide a principled framework for modeling structured data across multiple interacting graphs, addressing the limitations of the existing discrete methodologies. In this paper, we introduce Continuous Product Graph Neural Networks (CITRUS) that emerge as a natural solution to the TPDEG. CITRUS leverages the separability of continuous heat kernels from Cartesian graph products to efficiently implement graph spectral decomposition. We conduct thorough theoretical analyses of the stability and over-smoothing properties of CITRUS in response to domain-specific graph perturbations and graph spectra effects on the performance. We evaluate CITRUS on well-known traffic and weather spatiotemporal forecasting datasets, demonstrating superior performance over existing approaches. The implementation codes are available at https://github.com/ArefEinizade2/CITRUS.

Reinforcement Learning · Deep RL

Samin Yeasar Arnob, Riyasat Ohib, Sergey Plis, Amy Zhang, Alessandro Sordoni, Doina Precup

Reinforcement learning (RL) algorithms have been very successful at tackling complex control problems, such as AlphaGo or fusion control. However, current research mainly emphasizes solution quality, often achieved by using large models trained on large amounts of data, and does not account for the financial, environmental, and societal costs associated with developing and deploying such models. Modern neural networks are often overparameterized and a significant number of parameters can be pruned without meaningful loss in performance, resulting in more efficient use of the model's capacity lottery ticket. We present a methodology for identifying sub-networks within a larger network in reinforcement learning (RL). We call such sub-networks, neural pathways. We show empirically that even very small learned sub-networks, using less than 5% of the large network's parameters, can provide very good quality solutions. We also demonstrate the training of multiple pathways within the same networks in a multitask setup, where each pathway is encouraged to tackle a separate task. We evaluate empirically our approach on several continuous control tasks, in both online and offline training

Optimization · Large Scale, Parallel and Distributed

Penghui Qi, Xinyi Wan, Nyamdavaa Amar, Min Lin

Pipeline parallelism has been widely explored, but most existing schedules lack a systematic methodology. In this paper, we propose a framework to decompose pipeline schedules as repeating a building block, and show that the lifespan of the building block decides the peak activation memory of the pipeline schedule. Guided by the observations, we find that almost all existing pipeline schedules, to the best of our knowledge, are memory inefficient. To address this, we introduce a family of memory efficient building blocks with controllable activation memory, which can reduce the peak activation memory to 1/2 of 1F1B without sacrificing efficiency, and even to 1/3 with comparable throughput. We can also achieve almost zero pipeline bubbles while maintaining the same activation memory as 1F1B. Our evaluations demonstrate that in pure pipeline parallelism settings, our methods outperform 1F1B by from 7\% to 55\% in terms of throughput. When employing a grid search over hybrid parallelism hyperparameters in practical scenarios, our methods demonstrate a 16\% throughput improvement over the 1F1B baseline for large language models. The implementation is open-sourced at https://github.com/sail-sg/zero-bubble-pipeline-parallelism.

Computer Vision

Mathilde Caron, Alireza Fathi, Cordelia Schmid, Ahmet Iscen

Web-scale visual entity recognition, the task of associating images with their corresponding entities within vast knowledge bases like Wikipedia, presents significant challenges due to the lack of clean, large-scale training data. In this paper, we propose a novel methodology to curate such a dataset, leveraging a multimodal large language model (LLM) for label verification, metadata generation, and rationale explanation. Instead of relying on the multimodal LLM to directly annotate data, which we found to be suboptimal, we prompt it to reason about potential candidate entity labels by accessing additional contextually relevant information (such as Wikipedia), resulting in more accurate annotations. We further use the multimodal LLM to enrich the dataset by generating question-answer pairs and a grounded fine-grained textual description (referred to as "rationale") that explains the connection between images and their assigned entities. Experiments demonstrate that models trained on this automatically curated data achieve state-of-the-art performance on web-scale visual entity recognition tasks (e.g. +6.9% improvement in OVEN entity task), underscoring the importance of high-quality training data in this domain.

Learning Theory

seyed amir saberi, Amir Najafi, Amin Behjati, Ala Emrani, Yasaman Zolfimoselo, Shadrooy, Abolfazl Motahari, Babak Khalaj

The aim of this paper is to address the challenge of gradual domain adaptation within a class of manifold-constrained data distributions. In particular, we consider a sequence of $T\ge2$ data distributions $P_1,\ldots,P_T$ undergoing a gradual shift, where each pair of consecutive measures $P_i,P_{i+1}$ are close to each other in Wasserstein distance. We have a supervised dataset of size $n$ sampled from $P_0$, while for the subsequent distributions in the sequence, only unlabeled i.i.d. samples are available. Moreover, we assume that all distributions exhibit a known favorable attribute, such as (but not limited to) having intra-class soft/hard margins. In this context, we propose a methodology rooted in Distributionally Robust Optimization (DRO) with an adaptive Wasserstein radius. We theoretically show that this method guarantees the classification error across all $P_i$s can be suitably bounded. Our bounds rely on a newly introduced {\it {compatibility}} measure, which fully characterizes the error propagation dynamics along the sequence. Specifically, for inadequately constrained distributions, the error can exponentially escalate as we progress through the gradual shifts. Conversely, for appropriately constrained distributions, the error can be demonstrated to be linear or even entirely eradicated. We have substantiated our theoretical findings through several experimental results.

Multimodal Models

Hugo Malard, Michel Olvera, Stéphane Lathuilière, Slim Essid

Multimodal large language models have fueled progress in image captioning. These models, fine-tuned on vast image datasets, exhibit a deep understanding of semantic concepts.In this work, we show that this ability can be re-purposed for audio captioning, where the joint image-language decoder can be leveraged to describe auditory content associated with image sequences within videos featuring audiovisual content. This can be achieved via multimodal alignment.Yet, this multimodal alignment task is non-trivial due to the inherent disparity between audible and visible elements in real-world videos. Moreover, multimodal representation learning often relies on contrastive learning, facing the challenge of the so-called modality gap which hinders smooth integration between modalities. In this work, we introduce a novel methodology for bridging the audiovisual modality gap by matching the distributions of tokens produced by an audio backbone and those of an image captioner. Our approach aligns the audio token distribution with that of the image tokens, enabling the model to perform zero-shot audio captioning in an unsupervised fashion. This alignment allows for the use of either audio or audiovisual input by combining or substituting the image encoder with the aligned audio encoder. Our method achieves significantly improved performances in zero-shot audio captioning, compared to existing approaches.

Causality

Abbavaram Gowtham Reddy, Vineeth N Balasubramanian

Detecting and measuring confounding effects from data is a key challenge in causal inference. Existing methods frequently assume causal sufficiency, disregarding the presence of unobserved confounding variables. Causal sufficiency is both unrealistic and empirically untestable. Additionally, existing methods make strong parametric assumptions about the underlying causal generative process to guarantee the identifiability of confounding variables. Relaxing the causal sufficiency and parametric assumptions and leveraging recent advancements in causal discovery and confounding analysis with non-i.i.d. data, we propose a comprehensive approach for detecting and measuring confounding. We consider various definitions of confounding and introduce tailored methodologies to achieve three objectives: (i) detecting and measuring confounding among a set of variables, (ii) separating observed and unobserved confounding effects, and (iii) understanding the relative strengths of confounding bias between different sets of variables. We present useful properties of a confounding measure and present measures that satisfy those properties. Our empirical results support the usefulness of the proposed measures.

Applications

Lei Huang, Lei Xiong, Na Sun, Zunpeng Liu, Ka-Chun Wong, Manolis Kellis

The rapid advancement of single-cell ATAC sequencing (scATAC-seq) technologies holds great promise for investigating the heterogeneity of epigenetic landscapes at the cellular level. The amplification process in scATAC-seq experiments often introduces noise due to dropout events, which results in extreme sparsity that hinders accurate analysis. Consequently, there is a significant demand for the generation of high-quality scATAC-seq data in silico. Furthermore, current methodologies are typically task-specific, lacking a versatile framework capable of handling multiple tasks within a single model. In this work, we propose ATAC-Diff, a versatile framework, which is based on a diffusion model conditioned on the latent auxiliary variables to adapt for various tasks. ATAC-Diff is the first diffusion model for the scATAC-seq data generation and analysis, composed of auxiliary modules encoding the latent high-level variables to enable the model to learn the semantic information to sample high-quality data. Gaussian Mixture Model (GMM) as the latent prior and auxiliary decoder, the yield variables reserve the refined genomic information beneficial for downstream analyses. Another innovation is the incorporation of mutual information between observed and hidden variables as a regularization term to prevent the model from decoupling from latent variables. Through extensive experiments, we demonstrate that ATAC-Diff achieves high performance in both generation and analysis tasks, outperforming state-of-the-art models.

Multimodal Models

Juncheng Wu, Zhangkai Ni, Hanli Wang, Wenhan Yang, Yuyin Zhou, Shiqi Wang

Image deep features extracted by pre-trained networks are known to contain rich and informative representations. In this paper, we present Deep Degradation Response (DDR), a method to quantify changes in image deep features under varying degradation conditions. Specifically, our approach facilitates flexible and adaptive degradation, enabling the controlled synthesis of image degradation through text-driven prompts. Extensive evaluations demonstrate the versatility of DDR as an image descriptor, with strong correlations observed with key image attributes such as complexity, colorfulness, sharpness, and overall quality. Moreover, we demonstrate the efficacy of DDR across a spectrum of applications. It excels as a blind image quality assessment metric, outperforming existing methodologies across multiple datasets. Additionally, DDR serves as an effective unsupervised learning objective in image restoration tasks, yielding notable advancements in image deblurring and single-image super-resolution. Our code is available at: https://github.com/eezkni/DDR.

Generative Models · Diffusion models

Benyuan Meng, Qianqian Xu, Zitai Wang, Zhiyong Yang, Xiaochun Cao, Qingming Huang

Diffusion models are powerful generative models, and this capability can also be applied to discrimination. The inner activations of a pre-trained diffusion model can serve as features for discriminative tasks, namely, diffusion feature. We discover that diffusion feature has been hindered by a hidden yet universal phenomenon that we call content shift. To be specific, there are content differences between features and the input image, such as the exact shape of a certain object. We locate the cause of content shift as one inherent characteristic of diffusion models, which suggests the broad existence of this phenomenon in diffusion feature. Further empirical study also indicates that its negative impact is not negligible even when content shift is not visually perceivable. Hence, we propose to suppress content shift to enhance the overall quality of diffusion features. Specifically, content shift is related to the information drift during the process of recovering an image from the noisy input, pointing out the possibility of turning off-the-shelf generation techniques into tools for content shift suppression. We further propose a practical guideline named GATE to efficiently evaluate the potential benefit of a technique and provide an implementation of our methodology. Despite the simplicity, the proposed approach has achieved superior results on various tasks and datasets, validating its potential as a generic booster for diffusion features. Our code is available at https://github.com/Darkbblue/diffusion-content-shift.

Theory · Everything Else

Yao Zhao, Kwang-Sung Jun, Tanner Fiez, Lalit Jain

This paper introduces the confounded pure exploration transductive linear bandit (CPET-LB) problem. As a motivating example, often online services cannot directly assign users to specific control or treatment experiences either for business or practical reasons. In these settings, naively comparing treatment and control groups that may result from self-selection can lead to biased estimates of underlying treatment effects. Instead, online services can employ a properly randomized encouragement that incentivizes users toward a specific treatment. Our methodology provides online services with an adaptive experimental design approach for learning the best-performing treatment for such encouragement designs. We consider a more general underlying model captured by a linear structural equation and formulate pure exploration linear bandits in this setting. Though pure exploration has been extensively studied in standard adaptive experimental design settings, we believe this is the first work considering a setting where noise is confounded. Elimination-style algorithms using experimental design methods in combination with a novel finite-time confidence interval on an instrumental variable style estimator are presented with sample complexity upper bounds nearly matching a minimax lower bound. Finally, experiments are conducted that demonstrate the efficacy of our approach.

Causality

GUANG-YUAN HAO, Jiji Zhang, Biwei Huang, Hao Wang, Kun Zhang

Counterfactual reasoning is pivotal in human cognition and especially important for providing explanations and making decisions. While Judea Pearl's influential approach is theoretically elegant, its generation of a counterfactual scenario often requires too much deviation from the observed scenarios to be feasible, as we show using simple examples. To mitigate this difficulty, we propose a framework of natural counterfactuals and a method for generating counterfactuals that are more feasible with respect to the actual data distribution. Our methodology incorporates a certain amount of backtracking when needed, allowing changes in causally preceding variables to minimize deviations from realistic scenarios. Specifically, we introduce a novel optimization framework that permits but also controls the extent of backtracking with a "naturalness'' criterion. Empirical experiments demonstrate the effectiveness of our method. The code is available at https://github.com/GuangyuanHao/natural_counterfactuals.

Privacy

Bonwoo Lee, Jeongyoun Ahn, Cheolwoo Park

As the volume of data invested in statistical learning increases and concerns regarding privacy grow, the privacy leakage issue has drawn significant attention. Differential privacy has emerged as a widely accepted concept capable of mitigating privacy concerns, and numerous differentially private (DP) versions of machine learning algorithms have been developed. However, existing works on DP kernel learning algorithms have exhibited practical limitations, including scalability, restricted choice of kernels, or dependence on test data availability. We propose DP scalable kernel empirical risk minimization (ERM) algorithms and a DP kernel mean embedding (KME) release algorithm suitable for general kernels. Our approaches address the shortcomings of previous algorithms by employing Nyström methods, classical techniques in non-private scalable kernel learning. These methods provide data-dependent low-rank approximations of the kernel matrix for general kernels in a DP manner. We present excess empirical risk bounds and computational complexities for the scalable kernel DP ERM, KME algorithms, contrasting them with established methodologies. Furthermore, we develop a private data-generating algorithm capable of learning diverse kernel models. We conduct experiments to demonstrate the performance of our algorithms, comparing them with existing methods to highlight their superiority.

Deep Learning · Algorithms

Jie Ji, Gen Li, Jingjing Fu, Fatemeh Afghah, Linke Guo, Xiaoyong Yuan, Xiaolong Ma

Sparse training stands as a landmark approach in addressing the considerable training resource demands imposed by the continuously expanding size of Deep Neural Networks (DNNs). However, the training of a sparse DNN encounters great challenges in achieving optimal generalization ability despite the efforts from the state-of-the-art sparse training methodologies. To unravel the mysterious reason behind the difficulty of sparse training, we connect the network sparsity with neural loss functions structure, and identify the cause of such difficulty lies in chaotic loss surface. In light of such revelation, we propose $S^{2} - SAM$, characterized by a **S**ingle-step **S**harpness_**A**ware **M**inimization that is tailored for **S**parse training. For the first time, $S^{2} - SAM$ innovates the traditional SAM-style optimization by approximating sharpness perturbation through prior gradient information, incurring *zero extra cost*. Therefore, $S^{2} - SAM$ not only exhibits the capacity to improve generalization but also aligns with the efficiency goal of sparse training. Additionally, we study the generalization result of $S^{2} - SAM$ and provide theoretical proof for convergence. Through extensive experiments, $S^{2} - SAM$ demonstrates its universally applicable plug-and-play functionality, enhancing accuracy across various sparse training methods. Code available at https://github.com/jjsrf/SSAM-NEURIPS2024.

Deep Learning · Algorithms

Jianrong Ding, Zhanyu Liu, Guanjie Zheng, Haiming Jin, Linghe Kong

\textit{Dataset condensation} is a newborn technique that generates a small dataset that can be used in training deep neural networks (DNNs) to lower storage and training costs. The objective of dataset condensation is to ensure that the model trained with the synthetic dataset can perform comparably to the model trained with full datasets. However, existing methods predominantly concentrate on classification tasks, posing challenges in their adaptation to time series forecasting (TS-forecasting). This challenge arises from disparities in the evaluation of synthetic data. In classification, the synthetic data is considered well-distilled if the model trained with the full dataset and the model trained with the synthetic dataset yield identical labels for the same input, regardless of variations in output logits distribution. Conversely, in TS-forecasting, the effectiveness of synthetic data distillation is determined by the distance between predictions of the two models. The synthetic data is deemed well-distilled only when all data points within the predictions are similar. Consequently, TS-forecasting has a more rigorous evaluation methodology compared to classification. To mitigate this gap, we theoretically analyze the optimization objective of dataset condensation for TS-forecasting and propose a new one-line plugin of dataset condensation for TS-forecasting designated as Dataset \textbf{Cond}ensation for \textbf{T}ime \textbf{S}eries \textbf{F}orecasting (CondTSF) based on our analysis. Plugging CondTSF into previous dataset condensation methods facilitates a reduction in the distance between the predictions of the model trained with the full dataset and the model trained with the synthetic dataset, thereby enhancing performance. We conduct extensive experiments on eight commonly used time series datasets. CondTSF consistently improves the performance of all previous dataset condensation methods across all datasets, particularly at low condensing ratios.

Miscellaneous Aspects of Machine Learning · Transfer, Multitask and Meta-learning

Xu Yang, Chen Liu, Ying Wei

This paper introduces AMT, an \textbf{A}dversarial \textbf{M}eta-\textbf{T}uning methodology, to boost the robust generalization of pre-trained models in the out-of-domain (OOD) few-shot learning. To address the challenge of transferring knowledge from source domains to unseen target domains, we construct the robust LoRAPool by meta-tuning LoRAs with dual perturbations applied to not only the inputs but also singular values and vectors of the weight matrices at various robustness levels. On top of that, we introduce a simple yet effective test-time merging mechanism to dynamically merge discriminative LoRAs for test-time task customization. Extensive evaluations demonstrate that AMT yields significant improvements, up to 12.92\% in clean generalization and up to 49.72\% in adversarial generalization, over previous state-of-the-art methods across a diverse range of OOD few-shot image classification tasks on three benchmarks, confirming the effectiveness of our approach to boost the robust generalization of pre-trained models. Our code is available at \href{https://github.com/xyang583/AMT}{https://github.com/xyang583/AMT}.

Fairness

Muhammad Faaiz Taufiq, Jean-Francois Ton, Yang Liu

In machine learning fairness, training models that minimize disparity across different sensitive groups often leads to diminished accuracy, a phenomenon known as the fairness-accuracy trade-off. The severity of this trade-off inherently depends on dataset characteristics such as dataset imbalances or biases and therefore, using a uniform fairness requirement across diverse datasets remains questionable. To address this, we present a computationally efficient approach to approximate the fairness-accuracy trade-off curve tailored to individual datasets, backed by rigorous statistical guarantees. By utilizing the You-Only-Train-Once (YOTO) framework, our approach mitigates the computational burden of having to train multiple models when approximating the trade-off curve. Crucially, we introduce a novel methodology for quantifying uncertainty in our estimates, thereby providing practitioners with a robust framework for auditing model fairness while avoiding false conclusions due to estimation errors. Our experiments spanning tabular (e.g., Adult), image (CelebA), and language (Jigsaw) datasets underscore that our approach not only reliably quantifies the optimum achievable trade-offs across various data modalities but also helps detect suboptimality in SOTA fairness methods.

Deep Learning · Self-Supervised Learning

Zhimin Chen, Liang Yang, Yingwei Li, Longlong Jing, Bing Li

Foundation models have significantly enhanced 2D task performance, and recent works like Bridge3D have successfully applied these models to improve 3D scene understanding through knowledge distillation, marking considerable advancements. Nonetheless, challenges such as the misalignment between 2D and 3D representations and the persistent long-tail distribution in 3D datasets still restrict the effectiveness of knowledge distillation from 2D to 3D using foundation models. To tackle these issues, we introduce a novel SAM-guided tokenization method that seamlessly aligns 3D transformer structures with region-level knowledge distillation, replacing the traditional KNN-based tokenization techniques. Additionally, we implement a group-balanced re-weighting strategy to effectively address the long-tail problem in knowledge distillation. Furthermore, inspired by the recent success of masked feature prediction, our framework incorporates a two-stage masked token prediction process in which the student model predicts both the global embeddings and token-wise local embeddings derived from the teacher models trained in the first stage. Our methodology has been validated across multiple datasets, including SUN RGB-D, ScanNet, and S3DIS, for tasks like 3D object detection and semantic segmentation. The results demonstrate significant improvements over current state-of-the-art self-supervised methods, establishing new benchmarks in this field.

Data-centric AI · Data augmentation

Yunan Lu, Xiuyi Jia

Label distribution learning is a powerful learning paradigm to deal with label polysemy and has been widely applied in many practical tasks. A significant obstacle to the effective utilization of label distribution is the substantial expenses of accurate quantifying the label distributions. To tackle this challenge, label enhancement methods automatically infer label distributions from more easily accessible multi-label data based on binary annotations. However, the binary annotation of multi-label data requires experts to accurately assess whether each label can describe the instance, which may diminish the annotating efficiency and heighten the risk of erroneous annotation since the relationship between the label and the instance is unclear in many practical scenarios. Therefore, we propose to predict label distribution from ternary labels, allowing experts to annotate labels in a three-way annotation scheme. They can annotate the label as "$0$" indicating "uncertain relevant" if it is difficult to definitively determine whether the label can describe the instance, in addition to the binary annotation of "$1$" indicating "definitely relevant" and "$-1$" indicating "definitely irrelevant". Both the theoretical and methodological studies are conducted for the proposed learning paradigm. In the theoretical part, we conduct a quantitative comparison of approximation error between ternary and binary labels to elucidate the superiority of ternary labels over binary labels. In the methodological part, we propose a Categorical distribution with monotonicity and orderliness to model the mapping from label description degrees to ternary labels, which can serve as a loss function or as a probability distribution, allowing most existing label enhancement methods to be adapted to our task. Finally, we experimentally demonstrate the effectiveness of our proposal.