ICML 2024 Papers

This work considers the fundamental problem of learning an unknown object from training data using a given model class. We introduce a framework that allows for objects in arbitrary Hilbert spaces, general types of (random) linear measurements as training data and general types of nonlinear model classes. We establish a series of learning guarantees for this framework, which provide explicit relations between the amount of training data and the model class to ensure near-best generalization bounds. In doing so, we introduce the key notion of the *variation* of a model class with respect to a distribution of sampling operators. We show that this framework can accommodate many different types of well-known problems of interest, such as matrix sketching by random sampling, compressed sensing with isotropic vectors, active learning in regression and compressed sensing with generative models. In all cases, known results become straightforward corollaries of our general theory. Hence, this work provides a powerful framework for studying and analyzing many different types of learning problems.

Automated machine learning (AutoML) was formed around the fundamental objectives of automatically and efficiently configuring machine learning (ML) workflows, aiding the research of new ML algorithms, and contributing to the democratization of ML by making it accessible to a broader audience. Over the past decade, commendable achievements in AutoML have primarily focused on optimizing predictive performance. This focused progress, while substantial, raises questions about how well AutoML has met its broader, original goals. In this position paper, we argue that a key to unlocking AutoML's full potential lies in addressing the currently underexplored aspect of user interaction with AutoML systems, including their diverse roles, expectations, and expertise. We envision a more human-centered approach in future AutoML research, promoting the collaborative design of ML systems that tightly integrates the complementary strengths of human expertise and AutoML methodologies.

Modern computer vision pipelines handle large images in one of two sub-optimal ways: down-sampling or cropping. These two methods incur significant losses in the amount of information and context present in an image. There are many downstream applications in which global context matters as much as high frequency details, such as in real-world satellite imagery; in such cases researchers have to make the uncomfortable choice of which information to discard. We introduce *xT*, a simple framework for vision transformers which effectively aggregates global context with local details and can model large images end-to-end on contemporary GPUs. We select a set of benchmark datasets across classic vision tasks which accurately reflect a vision model's ability to understand truly large images and incorporate fine details over large scales and assess our method's improvement on them. *xT* is a streaming, two-stage architecture that adapts existing vision backbones and long sequence language models to effectively model large images without quadratic memory growth. We are able to increase accuracy by up to 8.6% on challenging classification tasks and F1 score by 11.6 on context-dependent segmentation on images as large as 29,000 x 29,000 pixels.

Large language models are increasingly integrated with external environments, tools, and agents like ChatGPT plugins to extend their capability beyond language-centric tasks. However, today's LLM inference systems are designed for standalone LLMs. They treat each external interaction as the end of LLM generation and form a new request when the interaction finishes, causing unnecessary recomputation of already computed contexts, which accounts for 37-40% of total model forwarding time. This paper presents **InferCept, the first LLM inference framework targeting augmented LLMs** and supporting the efficient interception of LLM generation. InferCept minimizes the GPU resource waste caused by LLM interceptions and dedicates saved memory for serving more requests.InferCept improves the overall serving throughput by **1.6x-2x** and completes 2x more requests per second compared to the state-of-the-art LLM inference systems.

In this paper, we introduce a novel class of fast, beam search-based adversarial attack (BEAST) for Language Models (LMs). BEAST employs interpretable parameters, enabling attackers to balance between attack speed, success rate, and the readability of adversarial prompts. The computational efficiency of BEAST facilitates us to investigate its applications on LMs for jailbreaking, eliciting hallucinations, and privacy attacks. Our gradient-free targeted attack can jailbreak aligned LMs with high attack success rates within one minute. For instance, BEAST can jailbreak Vicuna-7B-v1.5 under one minute with a success rate of 89% when compared to a gradient-based baseline that takes over an hour to achieve 70% success rate using a single Nvidia RTX A6000 48GB GPU. BEAST can also generate adversarial suffixes for successful jailbreaks that can transfer to unseen prompts and unseen models such as GPT-4-Turbo. Additionally, we discover a unique outcome wherein our untargeted attack induces hallucinations in LM chatbots. Through human evaluations, we find that our untargeted attack causes Vicuna-7B-v1.5 to produce $\sim$15% more incorrect outputs when compared to LM outputs in the absence of our attack. We also learn that 22% of the time, BEAST causes Vicuna to generate outputs that are not relevant to the original prompt. Further, we use BEAST to generate adversarial prompts in a few seconds that can boost the performance of existing membership inference attacks for LMs. We believe that our fast attack, BEAST, has the potential to accelerate research in LM security and privacy.

Machine learning on graphs, especially using graph neural networks (GNNs), has seen a surge in interest due to the wide availability of graph data across a broad spectrum of disciplines, from life to social and engineering sciences. Despite their practical success, our theoretical understanding of the properties of GNNs remains highly incomplete. Recent theoretical advancements primarily focus on elucidating the coarse-grained expressive power of GNNs, predominantly employing combinatorial techniques. However, these studies do not perfectly align with practice, particularly in understanding the generalization behavior of GNNs when trained with stochastic first-order optimization techniques. In this position paper, we argue that the graph machine learning community needs to shift its attention to developing a balanced theory of graph machine learning, focusing on a more thorough understanding of the interplay of expressive power, generalization, and optimization.

Machine learning has a long collaborative tradition with several fields of mathematics, such as statistics, probability and linear algebra. We propose a new direction for machine learning research: $C^*$-algebraic ML $-$ a cross-fertilization between $C^*$-algebra and machine learning. The mathematical concept of $C^*$-algebra is a natural generalization of the space of complex numbers. It enables us to unify existing learning strategies, and construct a new framework for more diverse and information-rich data models. We explain why and how to use $C^*$-algebras in machine learning, and provide technical considerations that go into the design of $C^*$-algebraic learning models in the contexts of kernel methods and neural networks. Furthermore, we discuss open questions and challenges in $C^*$-algebraic ML and give our thoughts for future development and applications.

The popularity of multiagent reinforcement learning (MARL) is growing rapidly with the demand for real-world tasks that require swarm intelligence. However, a noticeable drawback of MARL is its low sample efficiency, which leads to a huge amount of interactions with the environment. Surprisingly, few MARL works focus on this practical problem especially in the parallel environment setting, which greatly hampers the application of MARL into the real world. In response to this gap, in this paper, we propose Multiagent Reinforcement Learning with Reset Replay (MARR) to greatly improve the sample efficiency of MARL by enabling MARL training at a high replay ratio in the parallel environment setting for the first time. To achieve this, first, a reset strategy is introduced for maintaining the network plasticity to ensure that MARL continually learns with a high replay ratio. Second, MARR incorporates a data augmentation technique to boost the sample efficiency further. Extensive experiments in SMAC and MPE show that MARR significantly improves the performance of various MARL approaches with much fewer environment interactions.

Model-based reinforcement learning agents utilizing transformers have shown improved sample efficiency due to their ability to model extended context, resulting in more accurate world models. However, for complex reasoning and planning tasks, these methods primarily rely on continuous representations. This complicates modeling of discrete properties of the real world such as disjoint object classes between which interpolation is not plausible. In this work, we introduce discrete abstract representations for transformer-based learning (DART), a sample-efficient method utilizing discrete representations for modeling both the world and learning behavior. We incorporate a transformer-decoder for auto-regressive world modeling and a transformer-encoder for learning behavior by attending to task-relevant cues in the discrete representation of the world model. For handling partial observability, we aggregate information from past time steps as memory tokens. DART outperforms previous state-of-the-art methods that do not use look-ahead search on the Atari 100k sample efficiency benchmark with a median human-normalized score of 0.790 and beats humans in 9 out of 26 games. We release our code at https://pranaval.github.io/DART/.

Semi-implicit variational inference (SIVI) extends traditional variational families with semi-implicit distributions defined in a hierarchical manner. Due to the intractable densities of semi-implicit distributions, classical SIVI often resorts to surrogates of evidence lower bound (ELBO) that would introduce biases for training. A recent advancement in SIVI, named SIVI-SM, utilizes an alternative score matching objective made tractable via a minimax formulation, albeit requiring an additional lower-level optimization. In this paper, we propose kernel SIVI (KSIVI), a variant of SIVI-SM that eliminates the need for the lower-level optimization through kernel tricks. Specifically, we show that when optimizing over a reproducing kernel Hilbert space (RKHS), the lower-level problem has an explicit solution. This way, the upper-level objective becomes the kernel Stein discrepancy (KSD), which is readily computable for stochastic gradient descent due to the hierarchical structure of semi-implicit variational distributions. An upper bound for the variance of the Monte Carlo gradient estimators of the KSD objective is derived, which allows us to establish novel convergence guarantees of KSIVI. We demonstrate the effectiveness and efficiency of KSIVI on both synthetic distributions and a variety of real data Bayesian inference tasks.

Federated learning (FL) has enabled distributed learning of a model across multiple clients in a privacy-preserving manner. One of the main challenges of FL is to accommodate clients with varying hardware capacities; clients have differing compute and memory requirements. To tackle this challenge, recent state-of-the-art approaches leverage the use of early exits. Nonetheless, these approaches fall short of mitigating the challenges of joint learning multiple exit classifiers, often relying on hand-picked heuristic solutions for knowledge distillation among classifiers and/or utilizing additional layers for weaker classifiers. In this work, instead of utilizing multiple classifiers, we propose a recurrent early exit approach named ReeFL that fuses features from different sub-models into a single shared classifier. Specifically, we use a transformer-based early-exit module shared among sub-models to i) better exploit multi-layer feature representations for task-specific prediction and ii) modulate the feature representation of the backbone model for subsequent predictions. We additionally present a per-client self-distillation approach where the best sub-model is automatically selected as the teacher of the other sub-models at each client. Our experiments on standard image and speech classification benchmarks across various emerging federated fine-tuning baselines demonstrate ReeFL effectiveness over previous works.

Foundation models such as GPT-4 are fine-tuned to avoid unsafe or otherwise problematic behavior, such as helping to commit crimes or producing racist text. One approach to fine-tuning, called reinforcement learning from human feedback, learns from humans’ expressed preferences over multiple outputs. Another approach is constitutional AI, in which the input from humans is a list of high-level principles. But how do we deal with potentially diverging input from humans? How can we aggregate the input into consistent data about “collective” preferences or otherwise use it to make collective choices about model behavior? In this paper, we argue that the field of social choice is well positioned to address these questions, and we discuss ways forward for this agenda, drawing on discussions in a recent workshop on Social Choice for AI Ethics and Safety held in Berkeley, CA, USA in December 2023.

Large Language Models (LLMs) are trained on massive text corpora, which are encoded with diverse personality traits. This triggers an interesting goal of eliciting a desired personality trait from the LLM, and probing its behavioral preferences. Accordingly, we formalize the persona elicitation task, aiming to customize LLM behaviors to align with a target persona. We present Persona In-Context Learning (PICLe), a novel persona elicitation framework grounded in Bayesian inference. At the core, PICLe introduces a new ICL example selection criterion based on likelihood ratio, which is designed to optimally guide the model in eliciting a specific target persona. We demonstrate the effectiveness of PICLe through extensive comparisons against baseline methods across three contemporary LLMs. Code is available at https://github.com/deeplearning-wisc/picle.

The objective of traffic prediction is to accurately forecast and analyze the dynamics of transportation patterns, considering both space and time. However, the presence of distribution shift poses a significant challenge in this field, as existing models struggle to generalize well when faced with test data that significantly differs from the training distribution. To tackle this issue, this paper introduces a simple and universal spatio-temporal prompt-tuning framework-FlashST, which adapts pre-trained models to the specific characteristics of diverse downstream datasets, improving generalization in diverse traffic prediction scenarios. Specifically, the FlashST framework employs a lightweight spatio-temporal prompt network for in-context learning, capturing spatio-temporal invariant knowledge and facilitating effective adaptation to diverse scenarios. Additionally, we incorporate a distribution mapping mechanism to align the data distributions of pre-training and downstream data, facilitating effective knowledge transfer in spatio-temporal forecasting. Empirical evaluations demonstrate the effectiveness of our FlashST across different spatio-temporal prediction tasks using diverse urban datasets. Code is available at [https://github.com/HKUDS/FlashST](https://github.com/HKUDS/FlashST).

The limitations of purely neural learning have sparked an interest in probabilistic neurosymbolic models, which combine neural networks with probabilistic logical reasoning. As these neurosymbolic models are trained with gradient descent, we study the complexity of differentiating probabilistic reasoning. We prove that although approximating these gradients is intractable in general, it becomes tractable during training. Furthermore, we introduce *WeightME*, an unbiased gradient estimator based on model sampling. Under mild assumptions, WeightME approximates the gradient with probabilistic guarantees using a logarithmic number of calls to a SAT solver. Lastly, we evaluate the necessity of these guarantees on the gradient. Our experiments indicate that the existing biased approximations indeed struggle to optimize even when exact solving is still feasible.

In this paper, we conduct a comprehensive analysis of two dual-branch (Siamese architecture) self-supervised learning approaches, namely Barlow Twins and spectral contrastive learning, through the lens of matrix mutual information. We prove that the loss functions of these methods implicitly optimize both matrix mutual information and matrix joint entropy. This insight prompts us to further explore the category of single-branch algorithms, specifically MAE and U-MAE, for which mutual information and joint entropy become the entropy. Building on this intuition, we introduce the Matrix Variational Masked Auto-Encoder (M-MAE), a novel method that leverages the matrix-based estimation of entropy as a regularizer and subsumes U-MAE as a special case. The empirical evaluations underscore the effectiveness of M-MAE compared with the state-of-the-art methods, including a 3.9% improvement in linear probing ViT-Base, and a 1% improvement in fine-tuning ViT-Large, both on ImageNet.

Adaptive gradient optimizers like Adam(W) are the default training algorithms for many deep learning architectures, such as transformers. Their diagonal preconditioner is based on the gradient outer product which is incorporated into the parameter update via a square root. While these methods are often motivated as approximate second-order methods, the square root represents a fundamental difference. In this work, we investigate how the behavior of adaptive methods changes when we remove the root, i.e. strengthen their second-order motivation. Surprisingly, we find that such square-root-free adaptive methods close the generalization gap to SGD on convolutional architectures, while maintaining their root-based counterpart's performance on transformers. The second-order perspective also has practical benefits for the development of non-diagonal adaptive methods through the concept of preconditioner invariance. In contrast to root-based methods like Shampoo, the root-free counterparts do not require numerically unstable matrix root decompositions and inversions, thus work well in half precision. Our findings provide new insights into the development of adaptive methods and raise important questions regarding the currently overlooked role of adaptivity for their success.

Graph contrastive learning has made remarkable advances in settings where there is a scarcity of task-specific labels. Despite these advances, the significant computational overhead for representation inference incurred by existing methods that rely on intensive message passing makes them unsuitable for latency-constrained applications. In this paper, we present GraphECL, a simple and efficient contrastive learning method for fast inference on graphs. GraphECL does away with the need for expensive message passing during inference. Specifically, it introduces a novel coupling of the MLP and GNN models, where the former learns to computationally efficiently mimic the computations performed by the latter. We provide a theoretical analysis showing why MLP can capture essential structural information in neighbors well enough to match the performance of GNN in downstream tasks. The extensive experiments on widely used real-world benchmarks that show that GraphECL achieves superior performance and inference efficiency compared to state-of-the-art graph constrastive learning (GCL) methods on homophilous and heterophilous graphs.

In this paper, we examine the long-run distribution of stochastic gradient descent (SGD) in general, non-convex problems. Specifically, we seek to understand which regions of the problem's state space are more likely to be visited by SGD, and by how much. Using an approach based on the theory of large deviations and randomly perturbed dynamical systems, we show that the long-run distribution of SGD resembles the Boltzmann-Gibbs distribution of equilibrium thermodynamics with temperature equal to the method's step-size and energy levels determined by the problem's objective and the statistics of the noise. In particular, we show that, in the long run, (*a*) the problem's critical region is visited exponentially more often than any non-critical region; (*b*) the iterates of SGD are exponentially concentrated around the problem's minimum energy state (which does not always coincide with the global minimum of the objective); (*c*) all other connected components of critical points are visited with frequency that is exponentially proportional to their energy level; and, finally, (*d*) any component of local maximizers or saddle points is "dominated" by a component of local minimizers which is visited exponentially more often.