NeurIPS 2023 论文列表

Multi-task learning has emerged as a powerful machine learning paradigm for integrating data from multiple sources, leveraging similarities between tasks to improve overall model performance. However, the application of multi-task learning to real-world settings is hindered by data-sharing constraints, especially in healthcare settings. To address this challenge, we propose a flexible multi-task learning framework utilizing summary statistics from various sources. Additionally, we present an adaptive parameter selection approach based on a variant of Lepski's method, allowing for data-driven tuning parameter selection when only summary statistics are accessible. Our systematic non-asymptotic analysis characterizes the performance of the proposed methods under various regimes of the source datasets' sample complexity and overlap. We demonstrate our theoretical findings and the performance of the method through extensive simulations. This work offers a more flexible tool for training related models across various domains, with practical implications in genetic risk prediction and many other fields.

Empirical risk minimization (ERM) of neural networks is prone to over-reliance on spurious correlations and poor generalization on minority groups. The recent deep feature reweighting (DFR) technique achieves state-of-the-art group robustness via simple last-layer retraining, but it requires held-out group and class annotations to construct a group-balanced reweighting dataset. In this work, we examine this impractical requirement and find that last-layer retraining can be surprisingly effective with no group annotations (other than for model selection) and only a handful of class annotations. We first show that last-layer retraining can greatly improve worst-group accuracy even when the reweighting dataset has only a small proportion of worst-group data. This implies a "free lunch" where holding out a subset of training data to retrain the last layer can substantially outperform ERM on the entire dataset with no additional data, annotations, or computation for training. To further improve group robustness, we introduce a lightweight method called selective last-layer finetuning (SELF), which constructs the reweighting dataset using misclassifications or disagreements. Our experiments present the first evidence that model disagreement upsamples worst-group data, enabling SELF to nearly match DFR on four well-established benchmarks across vision and language tasks with no group annotations and less than 3% of the held-out class annotations.

The problem of urban event ranking aims at predicting the top-$k$ most risky locations of future events such as traffic accidents and crimes. This problem is of fundamental importance to public safety and urban administration especially when limited resources are available. The problem is, however, challenging due to complex and dynamic spatio-temporal correlations between locations, uneven distribution of urban events in space, and the difficulty to correctly rank nearby locations with similar features. Prior works on event forecasting mostly aim at accurately predicting the actual risk score or counts of events for all the locations. Rankings obtained as such usually have low quality due to prediction errors. Learning-to-rank methods directly optimize measures such as Normalized Discounted Cumulative Gain (NDCG), but cannot handle the spatiotemporal autocorrelation existing among locations. Due to the common assumption that items are independent. In this paper, we bridge the gap by proposing a novel spatial event ranking approach named SpatialRank. SpatialRank features adaptive graph convolution layers that dynamically learn the spatiotemporal dependencies across locations from data. In addition, the model optimizes through surrogates a hybrid NDCG loss with a spatial component to better rank neighboring spatial locations. We design an importance-sampling with a spatial filtering algorithm to effectively evaluate the loss during training. Comprehensive experiments on three real-world datasets demonstrate that SpatialRank can effectively identify the top riskiest locations of crimes and traffic accidents and outperform state-of-art methods in terms of NDCG by up to 12.7%.

We consider the problem of Learning from Label Proportions (LLP), a weakly supervised classification setup where instances are grouped into i.i.d. “bags”, and only the frequency of class labels at each bag is available. Albeit, the objective of the learner is to achieve low task loss at an individual instance level. Here we propose EASYLLP, a flexible and simple-to-implement debiasing approach based on aggregate labels, which operates on arbitrary loss functions. Our technique allows us to accurately estimate the expected loss of an arbitrary model at an individual level. We elucidate the differences between our method and standard methods based on label proportion matching, in terms of applicability and optimality conditions. We showcase the flexibility of our approach compared to alternatives by applying our method to popular learning frameworks, like Empirical Risk Minimization (ERM) and Stochastic Gradient Descent (SGD) with provable guarantees on instance level performance. Finally, we validate our theoretical results on multiple datasets, empirically illustrating the conditions under which our algorithm is expected to perform better or worse than previous LLP approaches

The training process of ReLU neural networks often exhibits complicated nonlinear phenomena. The nonlinearity of models and non-convexity of loss pose significant challenges for theoretical analysis. Therefore, most previous theoretical works on the optimization dynamics of neural networks focus either on local analysis (like the end of training) or approximate linear models (like Neural Tangent Kernel). In this work, we conduct a complete theoretical characterization of the training process of a two-layer ReLU network trained by Gradient Flow on a linearly separable data. In this specific setting, our analysis captures the whole optimization process starting from random initialization to final convergence. Despite the relatively simple model and data that we studied, we reveal four different phases from the whole training process showing a general simplifying-to-complicating learning trend. Specific nonlinear behaviors can also be precisely identified and captured theoretically, such as initial condensation, saddle-to-plateau dynamics, plateau escape, changes of activation patterns, learning with increasing complexity, etc.

Learning controllers with offline data in decision-making systems is an essential area of research due to its potential to reduce the risk of applications in real-world systems. However, in responsibility-sensitive settings such as healthcare, decision accountability is of paramount importance, yet has not been adequately addressed by the literature. This paper introduces the Accountable Offline Controller (AOC) that employs the offline dataset as the Decision Corpus and performs accountable control based on a tailored selection of examples, referred to as the Corpus Subset. AOC operates effectively in low-data scenarios, can be extended to the strictly offline imitation setting, and displays qualities of both conservation and adaptability. We assess AOC's performance in both simulated and real-world healthcare scenarios, emphasizing its capability to manage offline control tasks with high levels of performance while maintaining accountability.

We consider offline reinforcement learning (RL) where we only have only access to offline data. In contrast to numerous offline RL algorithms that necessitate the uniform coverage of the offline data over state and action space, we propose value-based algorithms with PAC guarantees under partial coverage, specifically, coverage of offline data against a single policy, and realizability of soft Q-function (a.k.a., entropy-regularized Q-function) and another function, which is defined as a solution to a saddle point of certain minimax optimization problem). Furthermore, we show the analogous result for Q-functions instead of soft Q-functions. To attain these guarantees, we use novel algorithms with minimax loss functions to accurately estimate soft Q-functions and Q-functions with -convergence guarantees measured on the offline data. We introduce these loss functions by casting the estimation problems into nonlinear convex optimization problems and taking the Lagrange functions.

In recent years, domains such as natural language processing and image recognition have popularized the paradigm of using large datasets to pretrain representations that can be effectively transferred to downstream tasks. In this work we evaluate how such a paradigm should be done in imitation learning, where both pretraining and finetuning data are trajectories collected by experts interacting with an unknown environment. Namely, we consider a setting where the pretraining corpus consists of multitask demonstrations and the task for each demonstration is set by an unobserved latent context variable. The goal is to use the pretraining corpus to learn a low dimensional representation of the high dimensional (e.g., visual) observation space which can be transferred to a novel context for finetuning on a limited dataset of demonstrations. Among a variety of possible pretraining objectives, we argue that inverse dynamics modeling -- i.e., predicting an action given the observations appearing before and after it in the demonstration -- is well-suited to this setting. We provide empirical evidence of this claim through evaluations on a variety of simulated visuomotor manipulation problems. While previous work has attempted various theoretical explanations regarding the benefit of inverse dynamics modeling, we find that these arguments are insufficient to explain the empirical advantages often observed in our settings, and so we derive a novel analysis using a simple but general environment model.

The elusive nature of gradient-based optimization in neural networks is tied to their loss landscape geometry, which is poorly understood. However recent work has brought solid evidence that there is essentially no loss barrier between the local solutions of gradient descent, once accounting for weight-permutations that leave the network's computation unchanged. This raises questions for approximate inference in Bayesian neural networks (BNNs), where we are interested in marginalizing over multiple points in the loss landscape. In this work, we first extend the formalism of marginalized loss barrier and solution interpolation to BNNs, before proposing a matching algorithm to search for linearly connected solutions. This is achieved by aligning the distributions of two independent approximate Bayesian solutions with respect to permutation matrices. Building on the work of Ainsworth et al. (2023), we frame the problem as a combinatorial optimization one, using an approximation to the sum of bilinear assignment problem. We then experiment on a variety of architectures and datasets, finding nearly zero marginalized loss barriers for linearly connected solutions.

We introduce Mind2Web, the first dataset for developing and evaluating generalist agents for the web that can follow language instructions to complete complex tasks on any website. Existing datasets for web agents either use simulated websites or only cover a limited set of websites and tasks, thus not suitable for generalist web agents. With over 2,000 open-ended tasks collected from 137 websites spanning 31 domains and crowdsourced action sequences for the tasks, Mind2Web provides three necessary ingredients for building generalist web agents: 1) diverse domains, websites, and tasks, 2) use of real-world websites instead of simulated and simplified ones, and 3) a broad spectrum of user interaction patterns. Based on Mind2Web, we conduct an initial exploration of using large language models (LLMs) for building generalist web agents. While the raw HTML of real-world websites are often too large to be fed to LLMs, we show that first filtering it with a small LM significantly improves the effectiveness and efficiency of LLMs. Our solution demonstrates a decent level of performance, even on websites or entire domains the model has never seen before, but there is still a substantial room to improve towards truly generalizable agents. We open-source our dataset, model implementation, and trained models (https://osu-nlp-group.github.io/Mind2Web) to facilitate further research on building a generalist agent for the web.

Meta-Bayesian optimisation (meta-BO) aims to improve the sample efficiency of Bayesian optimisation by leveraging data from related tasks. While previous methods successfully meta-learn either a surrogate model or an acquisition function independently, joint training of both components remains an open challenge. This paper proposes the first end-to-end differentiable meta-BO framework that generalises neural processes to learn acquisition functions via transformer architectures. We enable this end-to-end framework with reinforcement learning (RL) to tackle the lack of labelled acquisition data. Early on, we notice that training transformer-based neural processes from scratch with RL is challenging due to insufficient supervision, especially when rewards are sparse. We formalise this claim with a combinatorial analysis showing that the widely used notion of regret as a reward signal exhibits a logarithmic sparsity pattern in trajectory lengths. To tackle this problem, we augment the RL objective with an auxiliary task that guides part of the architecture to learn a valid probabilistic model as an inductive bias. We demonstrate that our method achieves state-of-the-art regret results against various baselines in experiments on standard hyperparameter optimisation tasks and also outperforms others in the real-world problems of mixed-integer programming tuning, antibody design, and logic synthesis for electronic design automation.

Diffusion models have gained increasing attention for their impressive generation abilities but currently struggle with rendering accurate and coherent text. To address this issue, we introduce TextDiffuser, focusing on generating images with visually appealing text that is coherent with backgrounds. TextDiffuser consists of two stages: first, a Transformer model generates the layout of keywords extracted from text prompts, and then diffusion models generate images conditioned on the text prompt and the generated layout. Additionally, we contribute the first large-scale text images dataset with OCR annotations, MARIO-10M, containing 10 million image-text pairs with text recognition, detection, and character-level segmentation annotations. We further collect the MARIO-Eval benchmark to serve as a comprehensive tool for evaluating text rendering quality. Through experiments and user studies, we demonstrate that TextDiffuser is flexible and controllable to create high-quality text images using text prompts alone or together with text template images, and conduct text inpainting to reconstruct incomplete images with text. We will make the code, model and dataset publicly available.

This work proposes POMP, a prompt pre-training method for vision-language models. Being memory and computation efficient, POMP enables the learned prompt to condense semantic information for a rich set of visual concepts with over twenty-thousand classes. Once pre-trained, the prompt with a strong transferable ability can be directly plugged into a variety of visual recognition tasks including image classification, semantic segmentation, and object detection, to boost recognition performances in a zero-shot manner. Empirical evaluation shows that POMP achieves state-of-the-art performances on 21 datasets, e.g., 67.0% average accuracy on 10 classification datasets (+3.1% compared to CoOp) and 84.4 hIoU on open-vocabulary Pascal VOC segmentation (+6.9 compared to ZSSeg).

Generative Pre-trained Transformer (GPT) models have exhibited exciting progress in capabilities, capturing the interest of practitioners and the public alike. Yet, while the literature on the trustworthiness of GPT models remains limited, practitioners have proposed employing capable GPT models for sensitive applications to healthcare and finance – where mistakes can be costly. To this end, this work proposes a comprehensive trustworthiness evaluation for large language models with a focus on GPT-4 and GPT-3.5, considering diverse perspectives – including toxicity, stereotype bias, adversarial robustness, out-of-distribution robustness, robustness on adversarial demonstrations, privacy, machine ethics, and fairness. Based on our evaluations, we discover previously unpublished vulnerabilities to trustworthiness threats. For instance, we find that GPT models can be easily misled to generate toxic and biased outputs and leak private information in both training data and conversation history. We also find that although GPT-4 is usually more trustworthy than GPT-3.5 on standard benchmarks, GPT-4 is more vulnerable given jailbreaking system or user prompts, potentially due to the reason that GPT-4 follows the (misleading) instructions more precisely. Our work illustrates a comprehensive trustworthiness evaluation of GPT models and sheds light on the trustworthiness gaps. Our benchmark is publicly available at https://decodingtrust.github.io/.

We study the problem of $\text{\emph{vector set search}}$ with $\text{\emph{vector set queries}}$. This task is analogous to traditional near-neighbor search, with the exception that both the query and each element in the collection are $\text{\textit{sets}}$ of vectors. We identify this problem as a core subroutine for semantic search applications and find that existing solutions are unacceptably slow. Towards this end, we present a new approximate search algorithm, DESSERT ($\text{\bf D}$ESSERT $\text{\bf E}$ffeciently $\text{\bf S}$earches $\text{\bf S}$ets of $\text{\bf E}$mbeddings via $\text{\bf R}$etrieval $\text{\bf T}$ables). DESSERT is a general tool with strong theoretical guarantees and excellent empirical performance. When we integrate DESSERT into ColBERT, a state-of-the-art semantic search model, we find a 2-5x speedup on the MS MARCO and LoTTE retrieval benchmarks with minimal loss in recall, underscoring the effectiveness and practical applicability of our proposal.

Observing the close relationship among panoptic, semantic and instance segmentation tasks, we propose to train a universal multi-dataset multi-task segmentation model: DaTaSeg. We use a shared representation (mask proposals with class predictions) for all tasks. To tackle task discrepancy, we adopt different merge operations and post-processing for different tasks. We also leverage weak-supervision, allowing our segmentation model to benefit from cheaper bounding box annotations. To share knowledge across datasets, we use text embeddings from the same semantic embedding space as classifiers and share all network parameters among datasets. We train DaTaSeg on ADE semantic, COCO panoptic, and Objects365 detection datasets. DaTaSeg improves performance on all datasets, especially small-scale datasets, achieving 54.0 mIoU on ADE semantic and 53.5 PQ on COCO panoptic. DaTaSeg also enables weakly-supervised knowledge transfer on ADE panoptic and Objects365 instance segmentation. Experiments show DaTaSeg scales with the number of training datasets and enables open-vocabulary segmentation through direct transfer. In addition, we annotate an Objects365 instance segmentation set of 1,000 images and release it as a public evaluation benchmark on https://laoreja.github.io/dataseg.

Knowledge Distillation (KD) has emerged as a promising approach for compressing large Pre-trained Language Models (PLMs). The performance of KD relies on how to effectively formulate and transfer the knowledge from the teacher model to the student model. Prior arts mainly focus on directly aligning output features from the transformer block, which may impose overly strict constraints on the student model's learning process and complicate the training process by introducing extra parameters and computational cost. Moreover, our analysis indicates that the different relations within self-attention, as adopted in other works, involves more computation complexities and can easily be constrained by the number of heads, potentially leading to suboptimal solutions. To address these issues, we propose a novel approach that builds relationships directly from output features. Specifically, we introduce token-level and sequence-level relations concurrently to fully exploit the knowledge from the teacher model. Furthermore, we propose a correlation-based distillation loss to alleviate the exact match properties inherent in traditional KL divergence or MSE loss functions. Our method, dubbed FCD, presents a simple yet effective method to compress various architectures (BERT, RoBERTa, and GPT) and model sizes (base-size and large-size). Extensive experimental results demonstrate that our distilled, smaller language models significantly surpass existing KD methods across various NLP tasks.

This paper studies the problem of active causal discovery when the experiments can be done based on multi-fidelity oracles, where higher fidelity experiments are more precise and expensive, while the lower ones are cheaper but less accurate. In this paper, we formally define the task of multi-fidelity active causal discovery, and design a probabilistic model for solving this problem. In specific, we first introduce a mutual-information based acquisition function to determine which variable should be intervened at which fidelity, and then a cascading model is proposed to capture the correlations between different fidelity oracles. Beyond the above basic framework, we also extend it to the batch intervention scenario. We find that the theoretical foundations behind the widely used and efficient greedy method do not hold in our problem. To solve this problem, we introduce a new concept called $\epsilon$-submodular, and design a constraint based fidelity model to theoretically validate the greedy method. We conduct extensive experiments to demonstrate the effectiveness of our model.

Graph neural networks (GNNs) have shown state-of-the-art performances in various applications. However, GNNs often struggle to capture long-range dependencies in graphs due to oversmoothing. In this paper, we generalize the concept of oversmoothing from undirected to directed graphs. To this aim, we extend the notion of Dirichlet energy by considering a directed symmetrically normalized Laplacian. As vanilla graph convolutional networks are prone to oversmooth, we adopt a neural graph ODE framework. Specifically, we propose fractional graph Laplacian neural ODEs, which describe non-local dynamics. We prove that our approach allows propagating information between distant nodes while maintaining a low probability of long-distance jumps. Moreover, we show that our method is more flexible with respect to the convergence of the graph’s Dirichlet energy, thereby mitigating oversmoothing. We conduct extensive experiments on synthetic and real-world graphs, both directed and undirected, demonstrating our method’s versatility across diverse graph homophily levels. Our code is available at https://github.com/RPaolino/fLode