NeurIPS 2023 Papers

The challenge of overfitting, in which the model memorizes the training data and fails to generalize to test data, has become increasingly significant in the training of large neural networks. To tackle this challenge, Sharpness-Aware Minimization (SAM) has emerged as a promising training method, which can improve the generalization of neural networks even in the presence of label noise. However, a deep understanding of how SAM works, especially in the setting of nonlinear neural networks and classification tasks, remains largely missing. This paper fills this gap by demonstrating why SAM generalizes better than Stochastic Gradient Descent (SGD) for a certain data model and two-layer convolutional ReLU networks. The loss landscape of our studied problem is nonsmooth, thus current explanations for the success of SAM based on the Hessian information are insufficient. Our result explains the benefits of SAM, particularly its ability to prevent noise learning in the early stages, thereby facilitating more effective learning of features. Experiments on both synthetic and real data corroborate our theory.

Hyperparameter optimization, also known as hyperparameter tuning, is a widely recognized technique for improving model performance. Regrettably, when training private ML models, many practitioners often overlook the privacy risks associated with hyperparameter optimization, which could potentially expose sensitive information about the underlying dataset. Currently, the sole existing approach to allow privacy-preserving hyperparameter optimization is to uniformly and randomly select hyperparameters for a number of runs, subsequently reporting the best-performing hyperparameter. In contrast, in non-private settings, practitioners commonly utilize "adaptive" hyperparameter optimization methods such as Gaussian Process-based optimization, which select the next candidate based on information gathered from previous outputs. This substantial contrast between private and non-private hyperparameter optimization underscores a critical concern. In our paper, we introduce DP-HyPO, a pioneering framework for "adaptive" private hyperparameter optimization, aiming to bridge the gap between private and non-private hyperparameter optimization. To accomplish this, we provide a comprehensive differential privacy analysis of our framework. Furthermore, we empirically demonstrate the effectiveness of DP-HyPO on a diverse set of real-world datasets.

Much of the previous work towards digital agents for graphical user interfaces (GUIs) has relied on text-based representations (derived from HTML or other structured data sources), which are not always readily available. These input representations have been often coupled with custom, task-specific action spaces. This paper focuses on creating agents that interact with the digital world using the same conceptual interface that humans commonly use — via pixel-based screenshots and a generic action space corresponding to keyboard and mouse actions. Building upon recent progress in pixel-based pretraining, we show, for the first time, that it is possible for such agents to outperform human crowdworkers on the MiniWob++ benchmark of GUI-based instruction following tasks.

Tensor decompositions (TDs) serve as a powerful tool for analyzing multiway data. Traditional TDs incorporate prior knowledge about the data into the model, such as a directed generative process from latent factors to observations. In practice, selecting proper structural or distributional assumptions beforehand is crucial for obtaining a promising TD representation. However, since such prior knowledge is typically unavailable in real-world applications, choosing an appropriate TD model can be challenging. This paper aims to address this issue by introducing a flexible TD framework that discards the structural and distributional assumptions, in order to learn as much information from the data. Specifically, we construct a TD model that captures the joint probability of the data and latent tensor factors through a deep energy-based model (EBM). Neural networks are then employed to parameterize the joint energy function of tensor factors and tensor entries. The flexibility of EBM and neural networks enables the learning of underlying structures and distributions. In addition, by designing the energy function, our model unifies the learning process of different types of tensors, such as static tensors and dynamic tensors with time stamps. The resulting model presents a doubly intractable nature due to the presence of latent tensor factors and the unnormalized probability function. To efficiently train the model, we derive a variational upper bound of the conditional noise-contrastive estimation objective that learns the unnormalized joint probability by distinguishing data from conditional noises. We show advantages of our model on both synthetic and several real-world datasets.

The rapid advancement of chat-based language models has led to remarkable progress in complex task-solving. However, their success heavily relies on human input to guide the conversation, which can be challenging and time-consuming. This paper explores the potential of building scalable techniques to facilitate autonomous cooperation among communicative agents, and provides insight into their “cognitive” processes. To address the challenges of achieving autonomous cooperation, we propose a novel communicative agent framework named role-playing . Our approach involves using inception prompting to guide chat agents toward task completion while maintaining consistency with human intentions. We showcase how role-playing can be used to generate conversational data for studying the behaviors and capabilities of a society of agents, providing a valuable resource for investigating conversational language models. In particular, we conduct comprehensive studies on instruction-following cooperation in multi-agent settings. Our contributions include introducing a novel communicative agent framework, offering a scalable approach for studying the cooperative behaviors and capabilities of multi-agent systems, and open-sourcing our library to support research on communicative agents and beyond: https://github.com/camel-ai/camel.

Federated Learning (FL) is a privacy-constrained decentralized machine learning paradigm in which clients enable collaborative training without compromising private data. However, how to learn a robust global model in the data-heterogeneous and model-heterogeneous FL scenarios is challenging. To address it, we resort to data-free knowledge distillation to propose a new FL method (namely DFRD). DFRD equips a conditional generator on the server to approximate the training space of the local models uploaded by clients, and systematically investigates its training in terms of fidelity, transferability and diversity. To overcome the catastrophic forgetting of the global model caused by the distribution shifts of the generator across communication rounds, we maintain an exponential moving average copy of the generator on the server. Additionally, we propose dynamic weighting and label sampling to accurately extract knowledge from local models. Finally, our extensive experiments on various image classification tasks illustrate that DFRD achieves significant performance gains compared to SOTA baselines.

Large Language Models (LLMs) have demonstrated remarkable capabilities in performing complex tasks. Moreover, recent research has shown that incorporating human-annotated rationales (e.g., Chain-of-Thought prompting) during in-context learning can significantly enhance the performance of these models, particularly on tasks that require reasoning capabilities. However, incorporating such rationales poses challenges in terms of scalability as this requires a high degree of human involvement. In this work, we present a novel framework, Amplifying Model Performance by Leveraging In-Context Learning with Post Hoc Explanations (AMPLIFY), which addresses the aforementioned challenges by automating the process of rationale generation. To this end, we leverage post hoc explanation methods which output attribution scores (explanations) capturing the influence of each of the input features on model predictions. More specifically, we construct automated natural language rationales that embed insights from post hoc explanations to provide corrective signals to LLMs. Extensive experimentation with real-world datasets demonstrates that our framework, AMPLIFY, leads to prediction accuracy improvements of about 10-25% over a wide range of tasks, including those where prior approaches which rely on human-annotated rationales such as Chain-of-Thought prompting fall short. Our work makes one of the first attempts at highlighting the potential of post hoc explanations as valuable tools for enhancing the effectiveness of LLMs. Furthermore, we conduct additional empirical analyses and ablation studies to demonstrate the impact of each of the components of AMPLIFY, which, in turn, lead to critical insights for refining in context learning.

We present HUME, a simple model-agnostic framework for inferring human labeling of a given dataset without any external supervision. The key insight behind our approach is that classes defined by many human labelings are linearly separable regardless of the representation space used to represent a dataset. HUME utilizes this insight to guide the search over all possible labelings of a dataset to discover an underlying human labeling. We show that the proposed optimization objective is strikingly well-correlated with the ground truth labeling of the dataset. In effect, we only train linear classifiers on top of pretrained representations that remain fixed during training, making our framework compatible with any large pretrained and self-supervised model. Despite its simplicity, HUME outperforms a supervised linear classifier on top of self-supervised representations on the STL-10 dataset by a large margin and achieves comparable performance on the CIFAR-10 dataset. Compared to the existing unsupervised baselines, HUME achieves state-of-the-art performance on four benchmark image classification datasets including the large-scale ImageNet-1000 dataset. Altogether, our work provides a fundamentally new view to tackle unsupervised learning by searching for consistent labelings between different representation spaces.

Diffusion-based generative models have achieved remarkable success in various domains. It trains a shared model on denoising tasks that encompass different noise levels simultaneously, representing a form of multi-task learning (MTL). However, analyzing and improving diffusion models from an MTL perspective remains under-explored. In particular, MTL can sometimes lead to the well-known phenomenon of $\textit{negative transfer}$, which results in the performance degradation of certain tasks due to conflicts between tasks. In this paper, we first aim to analyze diffusion training from an MTL standpoint, presenting two key observations: $\textbf{(O1)}$ the task affinity between denoising tasks diminishes as the gap between noise levels widens, and $\textbf{(O2)}$ negative transfer can arise even in diffusion training. Building upon these observations, we aim to enhance diffusion training by mitigating negative transfer. To achieve this, we propose leveraging existing MTL methods, but the presence of a huge number of denoising tasks makes this computationally expensive to calculate the necessary per-task loss or gradient. To address this challenge, we propose clustering the denoising tasks into small task clusters and applying MTL methods to them. Specifically, based on $\textbf{(O2)}$, we employ interval clustering to enforce temporal proximity among denoising tasks within clusters. We show that interval clustering can be solved using dynamic programming, utilizing signal-to-noise ratio, timestep, and task affinity for clustering objectives. Through this, our approach addresses the issue of negative transfer in diffusion models by allowing for efficient computation of MTL methods. We validate the efficacy of proposed clustering and its integration with MTL methods through various experiments, demonstrating 1) improved generation quality and 2) faster training convergence of diffusion models. Our project page is available at https://gohyojun15.github.io/ANT_diffusion/.

We present neural frailty machine (NFM), a powerful and flexible neural modeling framework for survival regressions. The NFM framework utilizes the classical idea of multiplicative frailty in survival analysis as a principled way of extending the proportional hazard assumption, at the same time being able to leverage the strong approximation power of neural architectures for handling nonlinear covariate dependence. Two concrete models are derived under the framework that extends neural proportional hazard models and nonparametric hazard regression models. Both models allow efficient training under the likelihood objective. Theoretically, for both proposed models, we establish statistical guarantees of neural function approximation with respect to nonparametric components via characterizing their rate of convergence. Empirically, we provide synthetic experiments that verify our theoretical statements. We also conduct experimental evaluations over $6$ benchmark datasets of different scales, showing that the proposed NFM models achieve predictive performance comparable to or sometimes surpassing state-of-the-art survival models. Our code is publicly availabel at https://github.com/Rorschach1989/nfm

As black-box machine learning models become more complex and are applied in high-stakes settings, the need for providing explanations for their predictions becomes crucial. Although Local Interpretable Model-agnostic Explanations (LIME) \cite{ribeiro2016should} is a widely adopted method for understanding model behavior, it suffers from instability with respect to random seeds \cite{zafar2019dlime, shankaranarayana2019alime, bansal2020sam} and exhibits low local fidelity (i.e., how the explanation explains model's local behaviors) \cite{rahnama2019study, laugel2018defining}. Our study demonstrates that this instability is caused by small sample weights, resulting in the dominance of regularization and slow convergence. Additionally, LIME's sampling approach is non-local and biased towards the reference, leading to diminished local fidelity and instability to references. To address these challenges, we propose \textsc{Glime}, an enhanced framework that extends LIME and unifies several previous methods. Within the \textsc{Glime} framework, we derive an equivalent formulation of LIME that achieves significantly faster convergence and improved stability. By employing a local and unbiased sampling distribution, \textsc{Glime} generates explanations with higher local fidelity compared to LIME, while being independent of the reference choice. Moreover, \textsc{Glime} offers users the flexibility to choose sampling distribution based on their specific scenarios.

Cloud-based machine learning inference is an emerging paradigm where users query by sending their data through a service provider who runs an ML model on that data and returns back the answer. Due to increased concerns over data privacy, recent works have proposed Collaborative Inference (CI) to learn a privacy-preserving encoding of sensitive user data before it is shared with an untrusted service provider. Existing works so far evaluate the privacy of these encodings through empirical reconstruction attacks. In this work, we develop a new framework that provides formal privacy guarantees for an arbitrarily trained neural network by linking its local Lipschitz constant with its local sensitivity. To guarantee privacy using local sensitivity, we extend the Propose-Test-Release (PTR) framework to make it tractable for neural network queries. We verify the efficacy of our framework experimentally on real-world datasets and elucidate the role of Adversarial Representation Learning (ARL) in improving the privacy-utility trade-off.

The bird's-eye-view (BEV) perception plays a critical role in autonomous driving systems, involving the accurate and efficient detection and tracking of objects from a top-down perspective. To achieve real-time decision-making in self-driving scenarios, low-latency computation is essential. While recent approaches to BEV detection have focused on improving detection precision using Lift-Splat-Shoot (LSS)-based or transformer-based schemas, the substantial computational and memory burden of these approaches increases the risk of system crashes when multiple on-vehicle tasks run simultaneously. Unfortunately, there is a dearth of literature on efficient BEV detector paradigms, let alone achieving realistic speedups. Unlike existing works that focus on reducing computation costs, this paper focuses on developing an efficient model design that prioritizes actual on-device latency. To achieve this goal, we propose a latency-aware design methodology that considers key hardware properties, such as memory access cost and degree of parallelism. Given the prevalence of GPUs as the main computation platform for autonomous driving systems, we develop a theoretical latency prediction model and introduce efficient building operators. By leveraging these operators and following an effective local-to-global visual modeling process, we propose a hardware-oriented backbone that is also optimized for strong feature capturing and fusing. Using these insights, we present a new hardware-oriented framework for efficient yet accurate camera-view BEV detectors. Experiments show that HotBEV achieves a 2\%$\sim$23\% NDS gain, and 2\%$\sim$7.8\% mAP gain with a 1.1$\times$$\sim$3.4$\times$ speedups compared to existing works on V100; On multiple GPU devices such as GPU GTX 2080 and the low-end GTX 1080, HotBEV achieves 1.1$\times$$\sim$6.3$\times$ faster than others.

Last-iterate convergence has received extensive study in two player zero-sum games starting from bilinear, convex-concave up to settings that satisfy the MVI condition. Typical methods that exhibit last-iterate convergence for the aforementioned games include extra-gradient (EG) and optimistic gradient descent ascent (OGDA). However, all the established last-iterate convergence results hold for the restrictive setting where the underlying repeated game does not change over time. Recently, a line of research has focused on regret analysis of OGDA in time-varying games, i.e., games where payoffs evolve with time; the last-iterate behavior of OGDA and EG in time-varying environments remains unclear though. In this paper, we study the last-iterate behavior of various algorithms in two types of unconstrained, time-varying, bilinear zero-sum games: periodic and convergent perturbed games. These models expand upon the usual repeated game formulation and incorporate external environmental factors, such as the seasonal effects on species competition and vanishing external noise. In periodic games, we prove that EG will converge while OGDA and momentum method will diverge. This is quite surprising, as to the best of our knowledge, it is the first result that indicates EG and OGDA have qualitatively different last-iterate behaviors and do not exhibit similar behavior. In convergent perturbed games, we prove all these algorithms converge as long as the game itself stabilizes with a faster rate than $1/t$.

Human activities are goal-oriented and hierarchical, comprising primary goals at the top level, sequences of steps and substeps in the middle, and atomic actions at the lowest level. Recognizing human activities thus requires relating atomic actions and steps to their functional objectives (what the actions contribute to) and modeling their sequential and hierarchical dependencies towards achieving the goals. Current activity recognition research has primarily focused on only the lowest levels of this hierarchy, i.e., atomic or low-level actions, often in trimmed videos with annotations spanning only a few seconds. In this work, we introduce Ego4D Goal-Step, a new set of annotations on the recently released Ego4D with a novel hierarchical taxonomy of goal-oriented activity labels. It provides dense annotations for 48K procedural step segments (430 hours) and high-level goal annotations for 2,807 hours of Ego4D videos. Compared to existing procedural video datasets, it is substantially larger in size, contains hierarchical action labels (goals - steps - substeps), and provides goal-oriented auxiliary information including natural language summary description, step completion status, and step-to-goal relevance information. We take a data-driven approach to build our taxonomy, resulting in dense step annotations that do not suffer from poor label-data alignment issues resulting from a taxonomy defined a priori. Through comprehensive evaluations and analyses, we demonstrate how Ego4D Goal-Step supports exploring various questions in procedural activity understanding, including goal inference, step prediction, hierarchical relation learning, and long-term temporal modeling.

Elastic geophysical properties (such as P- and S-wave velocities) are of great importance to various subsurface applications like CO$_2$ sequestration and energy exploration (e.g., hydrogen and geothermal). Elastic full waveform inversion (FWI) is widely applied for characterizing reservoir properties. In this paper, we introduce $\mathbf{\mathbb{E}^{FWI}}$, a comprehensive benchmark dataset that is specifically designed for elastic FWI. $\mathbf{\mathbb{E}^{FWI}}$ encompasses 8 distinct datasets that cover diverse subsurface geologic structures (flat, curve, faults, etc). The benchmark results produced by three different deep learning methods are provided. In contrast to our previously presented dataset (pressure recordings) for acoustic FWI (referred to as OpenFWI), the seismic dataset in $\mathbf{\mathbb{E}^{FWI}}$ has both vertical and horizontal components. Moreover, the velocity maps in $\mathbf{\mathbb{E}^{FWI}}$ incorporate both P- and S-wave velocities. While the multicomponent data and the added S-wave velocity make the data more realistic, more challenges are introduced regarding the convergence and computational cost of the inversion. We conduct comprehensive numerical experiments to explore the relationship between P-wave and S-wave velocities in seismic data. The relation between P- and S-wave velocities provides crucial insights into the subsurface properties such as lithology, porosity, fluid content, etc. We anticipate that $\mathbf{\mathbb{E}^{FWI}}$ will facilitate future research on multiparameter inversions and stimulate endeavors in several critical research topics of carbon-zero and new energy exploration. All datasets, codes and relevant information can be accessed through our website at https://efwi-lanl.github.io/

In-context learning (ICL) is one of the most powerful and most unexpected capabilities to emerge in recent transformer-based large language models (LLMs). Yet the mechanisms that underlie it are poorly understood. In this paper, we demonstrate that comparable ICL capabilities can be acquired by an alternative sequence prediction learning method using clone-structured causal graphs (CSCGs). Moreover, a key property of CSCGs is that, unlike transformer-based LLMs, they are {\em interpretable}, which considerably simplifies the task of explaining how ICL works. Specifically, we show that it uses a combination of (a) learning template (schema) circuits for pattern completion, (b) retrieving relevant templates in a context-sensitive manner, and (c) rebinding of novel tokens to appropriate slots in the templates. We go on to marshall evidence for the hypothesis that similar mechanisms underlie ICL in LLMs. For example, we find that, with CSCGs as with LLMs, different capabilities emerge at different levels of overparameterization, suggesting that overparameterization helps in learning more complex template (schema) circuits. By showing how ICL can be achieved with small models and datasets, we open up a path to novel architectures, and take a vital step towards a more general understanding of the mechanics behind this important capability.

Estimation of a complete univariate distribution from a sequence of observations is a useful primitive for both manual and automated decision making. This problem has received extensive attention in the i.i.d. setting, but the arbitrary data dependent setting remains largely unaddressed. We present computationally felicitous time-uniform and value-uniform bounds on the CDF of the running averaged conditional distribution of a sequence of real-valued random variables. Consistent with known impossibility results, our CDF bounds are always valid but sometimes trivial when the instance is too hard, and we give an instance-dependent convergence guarantee. The importance-weighted extension is appropriate for estimating complete counterfactual distributions of rewards given data from a randomized experiment, e.g., from an A/B test or a contextual bandit.

Understanding the behavior of non-human primates is crucial for improving animal welfare, modeling social behavior, and gaining insights into distinctively human and phylogenetically shared behaviors. However, the lack of datasets on non-human primate behavior hinders in-depth exploration of primate social interactions, posing challenges to research on our closest living relatives. To address these limitations, we present ChimpACT, a comprehensive dataset for quantifying the longitudinal behavior and social relations of chimpanzees within a social group. Spanning from 2015 to 2018, ChimpACT features videos of a group of over 20 chimpanzees residing at the Leipzig Zoo, Germany, with a particular focus on documenting the developmental trajectory of one young male, Azibo. ChimpACT is both comprehensive and challenging, consisting of 163 videos with a cumulative 160,500 frames, each richly annotated with detection, identification, pose estimation, and fine-grained spatiotemporal behavior labels. We benchmark representative methods of three tracks on ChimpACT: (i) tracking and identification, (ii) pose estimation, and (iii) spatiotemporal action detection of the chimpanzees. Our experiments reveal that ChimpACT offers ample opportunities for both devising new methods and adapting existing ones to solve fundamental computer vision tasks applied to chimpanzee groups, such as detection, pose estimation, and behavior analysis, ultimately deepening our comprehension of communication and sociality in non-human primates.