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Reinforcement Learning · Multi-agent

Cassidy Laidlaw, Eli Bronstein, Timothy Guo, Dylan Feng, Lukas Berglund, Justin Svegliato, Stuart Russell, Anca Dragan

Assistance games are a promising alternative to reinforcement learning from human feedback (RLHF) for training AI assistants. Assistance games resolve key drawbacks of RLHF, such as incentives for deceptive behavior, by explicitly modeling the interaction between assistant and user as a two-player game where the assistant cannot observe their shared goal. Despite their potential, assistance games have only been explored in simple settings. Scaling them to more complex environments is difficult because it requires both solving intractable decision-making problems under uncertainty and accurately modeling human users' behavior. We present the first scalable approach to solving assistance games and apply it to a new, challenging Minecraft-based assistance game with over $10^{400}$ possible goals. Our approach, AssistanceZero, extends AlphaZero with a neural network that predicts human actions and rewards, enabling it to plan under uncertainty. We show that AssistanceZero outperforms model-free RL algorithms and imitation learning in the Minecraft-based assistance game. In a human study, our AssistanceZero-trained assistant significantly reduces the number of actions participants take to complete building tasks in Minecraft. Our results suggest that assistance games are a tractable framework for training effective AI assistants in complex environments. Code and videos are available at https://anonymous.4open.science/w/scalably-solving-assistance-games/.

Optimization

Fabian Schaipp, Alexander Hägele, Adrien Taylor, Umut Simsekli, Francis Bach

We show that learning-rate schedules for large model training behave surprisingly similar to a performance bound from non-smooth convex optimization theory. We provide a bound for the constant schedule with linear cooldown; in particular, the practical benefit of cooldown is reflected in the bound due to the absence of logarithmic terms.Further, we show that this surprisingly close match between optimization theory and practice can be exploited for learning-rate tuning: we achieve noticeable improvements for training 124M and 210M Llama-type models by (i) extending the schedule for continued training with optimal learning-rate, and (ii) transferring the optimal learning-rate across schedules.

Deep Learning · Generative Models and Autoencoders

Fangyikang Wang, Hubery Yin, Shaobin Zhuang, Huminhao Zhu, Yinan Li, Lei Qian, Chao Zhang, Hanbin Zhao, Hui Qian, Chen Li

Recent Diffusion models (DMs) advancements have explored incorporating the second-order diffusion Fisher information (DF), defined as the negative Hessian of log density, into various downstream tasks and theoretical analysis.However, current practices typically approximate the diffusion Fisher by applying auto-differentiation to the learned score network. This black-box method, though straightforward, lacks any accuracy guarantee and is time-consuming.In this paper, we show that the diffusion Fisher actually resides within a space spanned by the outer products of score and initial data.Based on the outer-product structure, we develop two efficient approximation algorithms to access the trace and matrix-vector multiplication of DF, respectively.These algorithms bypass the auto-differentiation operations with time-efficient vector-product calculations. Furthermore, we establish the approximation error bounds for the proposed algorithms.Experiments in likelihood evaluation and adjoint optimization demonstrate the superior accuracy and reduced computational cost of our proposed algorithms.Additionally, based on the novel outer-product formulation of DF, we design the first numerical verification experiment for the optimal transport property of the general PF-ODE deduced map.

Deep Learning · Robustness

Zichao Li, Xueru Wen, Jie Lou, Yuqiu Ji, Yaojie Lu, Xianpei Han, Debing Zhang, Le Sun

Multimodal Reward Models (MM-RMs) are crucial for aligning Large Language Models (LLMs) with human preferences, particularly as LLMs increasingly interact with multimodal data. However, we find that MM-RMs trained on existing datasets often struggle to generalize to out-of-distribution data due to their reliance on unimodal spurious correlations, primarily text-only shortcuts within the training distribution, which prevents them from leveraging true multimodal reward functions. To address this, we introduce a Shortcut-aware MM-RM learning algorithm that mitigates this issue by dynamically reweighting training samples, shifting the distribution toward better multimodal understanding, and reducing dependence on unimodal spurious correlations. Our experiments demonstrate significant improvements in generalization, downstream task performance, and scalability, establishing a more robust framework for multimodal reward modeling. Our source code is provided on https://github.com/alignrm/Generalizable-MM-RM.

Deep Learning · Theory

Divyat Mahajan, Mohammad Pezeshki, Charles Arnal, Ioannis Mitliagkas, Kartik Ahuja, Pascal Vincent

Compositional generalization is a crucial step towards developing data-efficient intelligent machines that generalize in human-like ways. In this work, we tackle a challenging form of distribution shift, termed compositional shift, where some attribute combinations are completely absent at training but present in the test distribution. This shift tests the model's ability to generalize compositionally to novel attribute combinations in discriminative tasks. We model the data with flexible additive energy distributions, where each energy term represents an attribute, and derive a simple alternative to empirical risk minimization termed compositional risk minimization (CRM). We first train an additive energy classifier to predict the multiple attributes and then adjust this classifier to tackle compositional shifts. We provide an extensive theoretical analysis of CRM, where we show that our proposal extrapolates to special affine hulls of seen attribute combinations. Empirical evaluations on benchmark datasets confirms the improved robustness of CRM compared to other methods from the literature designed to tackle various forms of subpopulation shifts.

Theory · Online Learning and Bandits

Matei Gabriel Cosa, Marek Elias

Combining algorithms is one of the key techniques in learning-augmented algorithms.We consider the following problem:We are given $\ell$ heuristicsfor Metrical Task Systems (MTS), where each might be tailored to a different typeof input instances.While processing an input instance received online,we are allowed to query the action of only one of the heuristics at each time step.Our goal is to achieve performance comparable to the best of the given heuristics.The main difficulty of our setting comes from the fact thatthe cost paid by a heuristic at time $t$ cannot be estimatedunless the same heuristic was also queried at time $t-1$.This is related to Bandit Learning against memory boundedadversaries (Arora et al., 2012).We show how to achieve regret of $O(\text{OPT}^{2/3})$and prove a tight lower bound based on the constructionof Dekel et al. (2013).

Deep Learning · Large Language Models

Fan Zhou, Zengzhi Wang, Qian Liu, Junlong Li, Pengfei Liu

Large language model pre-training has traditionally relied on human experts to craft heuristics for improving the corpora quality, resulting in numerous rules developed to date. However, these fixed rules lack the flexibility to address the unique characteristics of individual examples, yet crafting sample-wise rules is impractical for human experts. In this paper, we show that even small language models, with only 0.3B parameters, can exhibit substantial data refining capabilities. We propose Programming Every Example (ProX), a novel framework that treats data refinement as a programming task, and enables the model to refine corpora by generating and executing fine-grained operations, such as string normalization, for each individual example at scale. Experiments show that models trained on ProX-refined data consistently outperform other baselines across 10 benchmarks, demonstrating effectiveness across model sizes (up to 1.7B) and pre-training corpora (C4, RedPajama-V2, FineWeb, FineWeb-Edu, and DCLM).ProX also shows great potential in continual pre-training: on math domain, ProX boosts 7B models by up to 20% within 10B tokens—results typically achieved with much larger scale training (e.g., 200B tokens).We believe ProX offers a way to curate high-quality pre-training data, and finally contributes to efficient LLM development.

Deep Learning · Robustness

Zheng Zhou, Wenquan Feng, Qiaosheng Zhang, Shuchang Lyu, Qi Zhao, Guangliang Cheng

Dataset Distillation (DD) compresses large datasets into smaller, synthetic subsets, enabling models trained on them to achieve performance comparable to those trained on the full data. However, these models remain vulnerable to adversarial attacks, limiting their use in safety-critical applications. While adversarial robustness has been extensively studied in related fields, research on improving DD robustness is still limited. To address this, we propose ROME, a novel method that enhances the adversarial RObustness of DD by leveraging the InforMation BottlenEck (IB) principle. ROME includes two components: a performance-aligned term to preserve accuracy and a robustness-aligned term to improve robustness by aligning feature distributions between synthetic and perturbed images. Furthermore, we introduce the Improved Robustness Ratio (I-RR), a refined metric to better evaluate DD robustness. Extensive experiments on CIFAR-10 and CIFAR-100 demonstrate that ROME outperforms existing DD methods in adversarial robustness, achieving maximum I-RR improvements of nearly 40% under white-box attacks and nearly 35% under black-box attacks. Our code is available at https://github.com/zhouzhengqd/ROME.

Deep Learning · Sequential Models, Time series

Weiwei Ye, Zhuopeng Xu, Ning Gui

Due to the dynamics of underlying physics and external influences, the uncertainty of time series often varies over time. However, existing Denoising Diffusion Probabilistic Models (DDPMs) often fail to capture this non-stationary nature, constrained by their constant variance assumption from the additive noise model (ANM). In this paper, we innovatively utilize the Location-Scale Noise Model (LSNM) to relax the fixed uncertainty assumption of ANM. A diffusion-based probabilistic forecasting framework, termed Non-stationary Diffusion (NsDiff), is designed based on LSNM that is capable of modeling the changing pattern of uncertainty. Specifically, NsDiff combines a denoising diffusion-based conditional generative model with a pre-trained conditional mean and variance estimator, enabling adaptive endpoint distribution modeling. Furthermore, we propose an uncertainty-aware noise schedule, which dynamically adjusts the noise levels to accurately reflect the data uncertainty at each step and integrates the time-varying variances into the diffusion process. Extensive experiments conducted on nine real-world and synthetic datasets demonstrate the superior performance of NsDiff compared to existing approaches. Code is available at https://github.com/wwy155/NsDiff.

Deep Learning · Graph Neural Networks

Jincheng Huang, Yujie Mo, Xiaoshuang Shi, Lei Feng, Xiaofeng Zhu

The message-passing mechanism of graph convolutional networks (i.e., GCNs) enables label information to reach more unlabeled neighbors, thereby increasing the utilization of labels. However, the additional label information does not always contribute positively to the GCN. To address this issue, we propose a new two-step framework called ELU-GCN. In the first stage, ELU-GCN conducts graph learning to learn a new graph structure (i.e., ELU-graph), which allows the additional label information to positively influence the predictions of GCN. In the second stage, we design a new graph contrastive learning on the GCN framework for representation learning by exploring the consistency and mutually exclusive information between the learned ELU graph and the original graph. Moreover, we theoretically demonstrate that the proposed method can ensure the generalization ability of GCNs. Extensive experiments validate the superiority of our method.

Deep Learning · Attention Mechanisms

Saúl Santos, António Farinhas, Daniel McNamee, Andre Martins

Current video-language models struggle with long-video understanding due to limited context lengths and reliance on sparse frame subsampling, which often leads to information loss. In this paper, we introduce $\infty$-Video, which is able to process arbitrarily long videos through a continuous-time long-term memory (LTM) consolidation mechanism. Our framework augments video Q-formers by making them able to process unbounded video contexts efficiently and without requiring additional training. Through continuous attention, our approach dynamically allocates higher granularity to the most relevant video segments, forming "sticky" memories which evolve over time. Experiments with Video-LLaMA and VideoChat2 demonstrate improved performance in video question-answering tasks, showcasing the potential of continuous-time LTM mechanisms to enable scalable and training-free comprehension of long videos.

Deep Learning · Robustness

Zijian Cheng, 贾 子怡, Zhi Zhou, Yu-Feng Li, Lan-Zhe Guo

Tabular data is widely utilized in various machine learning tasks. Current tabular learning research predominantly focuses on closed environments, while in real-world applications, open environments are often encountered, where distribution and feature shifts occur, leading to significant degradation in model performance. Previous research has primarily concentrated on mitigating distribution shifts, whereas feature shifts, a distinctive and unexplored challenge of tabular data, have garnered limited attention. To this end, this paper conducts the first comprehensive study on feature shifts in tabular data and introduces the first **tab**ular **f**eature-**s**hift **bench**mark (TabFSBench). TabFSBench evaluates impacts of four distinct feature-shift scenarios on four tabular model categories across various datasets and assesses the performance of large language models (LLMs) and tabular LLMs in the tabular benchmark for the first time. Our study demonstrates three main observations: (1) most tabular models have the limited applicability in feature-shift scenarios; (2) the shifted feature set importance has a linear relationship with model performance degradation; (3) model performance in closed environments correlates with feature-shift performance. Future research direction is also explored for each observation.Benchmark: [LAMDASZ-ML/TabFSBench](https://github.com/LAMDASZ-ML/TabFSBench).

Applications

Chao, Shisong Tang, Fan Li, Jiechao Gao, Hechang Chen

Accurately predicting user watch-time is crucial for enhancing user stickiness and retention in video recommendation systems. Existing watch-time prediction approaches typically involve transformations of watch-time labels for prediction and subsequent reversal, ignoring both the natural distribution properties of label and the \textit{instance representation confusion} that results in inaccurate predictions. In this paper, we propose ProWTP, a two-stage method combining prototype learning and optimal transport for watch-time regression prediction, suitable for any deep recommendation model. Specifically, we observe that the watch-ratio (the ratio of watch-time to video duration) within the same duration bucket exhibits a multimodal distribution. To facilitate incorporation into models, we use a hierarchical vector quantised variational autoencoder (HVQ-VAE) to convert the continuous label distribution into a high-dimensional discrete distribution, serving as credible prototypes for calibrations. Based on this, ProWTP views the alignment between prototypes and instance representations as a Semi-relaxed Unbalanced Optimal Transport (SUOT) problem, where the marginal constraints of prototypes are relaxed. And the corresponding optimization problem is reformulated as a weighted Lasso problem for solution. Moreover, ProWTP introduces the assignment and compactness losses to encourage instances to cluster closely around their respective prototypes, thereby enhancing the prototype-level distinguishability. Finally, we conducted extensive offline experiments on two industrial datasets, demonstrating our consistent superiority in real-world application.

Social Aspects · Safety

Mahdi Sabbaghi, Paul Kassianik, George Pappas, Amin Karbasi, Hamed Hassani

As large language models (LLMs) are becoming more capable and widespread, the study of their failure cases is becoming increasingly important. Recent advances in standardizing, measuring, and scaling test-time compute suggest new methodologies for optimizing models to achieve high performance on hard tasks. In this paper, we apply these advances to the task of model jailbreaking: eliciting harmful responses from aligned LLMs. We develop an adversarial reasoning approach to automatic jailbreaking that leverages a loss signal to guide the test-time compute, achieving SOTA attack success rates against many aligned LLMs, even those that aim to trade inference-time compute for adversarial robustness. Our approach introduces a new paradigm in understanding LLM vulnerabilities, laying the foundation for the development of more robust and trustworthy AI systems.

Deep Learning · Robustness

Shuangpeng Han, Mengmi Zhang

AI models make mistakes when recognizing images—whether in-domain, out-of-domain, or adversarial. Predicting these errors is critical for improving system reliability, reducing costly mistakes, and enabling proactive corrections in real-world applications such as healthcare, finance, and autonomous systems. However, understanding what mistakes AI models make, why they occur, and how to predict them remains an open challenge. Here, we conduct comprehensive empirical evaluations using a "mentor" model—a deep neural network designed to predict another "mentee" model’s errors. Our findings show that the mentor excels at learning from a mentee's mistakes on adversarial images with small perturbations and generalizes effectively to predict in-domain and out-of-domain errors of the mentee. Additionally, transformer-based mentor models excel at predicting errors across various mentee architectures. Subsequently, we draw insights from these observations and develop an "oracle" mentor model, dubbed SuperMentor, that can outperform baseline mentors in predicting errors across different error types from the ImageNet-1K dataset. Our framework paves the way for future research on anticipating and correcting AI model behaviors, ultimately increasing trust in AI systems. Our data and code are available at [here](https://github.com/ZhangLab-DeepNeuroCogLab/UnveilAIBlindSpot).

Reinforcement Learning · Deep RL

Motoki Omura, Kazuki Ota, Takayuki Osa, Yusuke Mukuta, Tatsuya Harada

For continuous action spaces, actor-critic methods are widely used in online reinforcement learning (RL). However, unlike RL algorithms for discrete actions, which generally model the optimal value function using the Bellman optimality operator, RL algorithms for continuous actions typically model Q-values for the current policy using the Bellman operator. These algorithms for continuous actions rely exclusively on policy updates for improvement, which often results in low sample efficiency. This study examines the effectiveness of incorporating the Bellman optimality operator into actor-critic frameworks. Experiments in a simple environment show that modeling optimal values accelerates learning but leads to overestimation bias. To address this, we propose an annealing approach that gradually transitions from the Bellman optimality operator to the Bellman operator, thereby accelerating learning while mitigating bias. Our method, combined with TD3 and SAC, significantly outperforms existing approaches across various locomotion and manipulation tasks, demonstrating improved performance and robustness to hyperparameters related to optimality.

Deep Learning · Everything Else

Manu Bhat, Jonghyun Park, Jianke Yang, Nima Dehmamy, Robin Walters, Rose Yu

Existing symmetry discovery methods predominantly focus on global transformations across the entire system or space, but they fail to consider the symmetries in local neighborhoods. This may result in the reported symmetry group being a misrepresentation of the true symmetry. In this paper, we formalize the notion of local symmetry as atlas equivariance. Our proposed pipeline, automatic local symmetry discovery (AtlasD), recovers the local symmetries of a function by training local predictor networks and then learning a Lie group basis to which the predictors are equivariant. We demonstrate AtlasD is capable of discovering local symmetry groups with multiple connected components in top-quark tagging and partial differential equation experiments. The discovered local symmetry is shown to be a useful inductive bias that improves the performance of downstream tasks in climate segmentation and vision tasks. Our code is publicly available at https://github.com/Rose-STL-Lab/AtlasD.

Social Aspects · Safety

Yichi Zhang, Siyuan Zhang, Yao Huang, Zeyu Xia, Zhengwei Fang, Xiao Yang, Ranjie Duan, Dong Yan, Yinpeng Dong, Jun Zhu

Ensuring the safety and harmlessness of Large Language Models (LLMs) has become equally critical as their performance in applications. However, existing safety alignment methods typically suffer from safety-performance trade-offs and susceptibility to jailbreak attacks, primarily due to their reliance on direct refusals for malicious queries. In this paper, we propose **STAIR**, a novel framework that integrates **S**afe**T**y **A**lignment with **I**trospective **R**easoning. We enable LLMs to identify safety risks through step-by-step analysis by self-improving chain-of-thought (CoT) reasoning with safety awareness. STAIR first equips the model with a structured reasoning capability and then advances safety alignment via iterative preference optimization on step-level reasoning data generated using our newly proposed Safety-Informed Monte Carlo Tree Search (SI-MCTS). Specifically, we design a theoretically grounded reward for outcome evaluation to seek balance between helpfulness and safety. We further train a process reward model on this data to guide test-time searches for improved responses. Extensive experiments show that STAIR effectively mitigates harmful outputs while better preserving helpfulness, compared to instinctive alignment strategies. With test-time scaling, STAIR achieves a safety performance comparable to Claude-3.5 against popular jailbreak attacks. We have open-sourced our code, datasets and models at https://github.com/thu-ml/STAIR.

Theory · Learning Theory

Yedi Zhang, Aaditya Singh, Peter Latham, Andrew Saxe

While attention-based models have demonstrated the remarkable ability of in-context learning (ICL), the theoretical understanding of how these models acquired this ability through gradient descent training is still preliminary. Towards answering this question, we study the gradient descent dynamics of multi-head linear self-attention trained for in-context linear regression. We examine two parametrizations of linear self-attention: one with the key and query weights merged as a single matrix (common in theoretical studies), and one with separate key and query matrices (closer to practical settings). For the merged parametrization, we show that the training dynamics has two fixed points and the loss trajectory exhibits a single, abrupt drop. We derive an analytical time-course solution for a certain class of datasets and initialization. For the separate parametrization, we show that the training dynamics has exponentially many fixed points and the loss exhibits saddle-to-saddle dynamics, which we reduce to scalar ordinary differential equations. During training, the model implements principal component regression in context with the number of principal components increasing over training time. Overall, we provide a theoretical description of how ICL abilities evolve during gradient descent training of linear attention, revealing abrupt acquisition or progressive improvements depending on how the key and query are parametrized.

Deep Learning · Attention Mechanisms

Yuan Tian, Tianyi Zhang

Recent advances in large language models (LLMs) have transformed software development by automatically generating code from natural language. Yet challenges remain in generating fully correct code that aligns with user intent. Our study reveals that LLMs tend to pay less attention to user prompts as more code tokens are generated. We hypothesize that this attention dilution issue is an important reason for code generation errors. To mitigate this issue, we propose ***S**elective **P**rompt **A**nchoring* (SPA) to guide code LLMs to pay more attention to user intent when generating code. We evaluate SPA using six base LLMs across six benchmarks. Our results demonstrate that SPA enhances Pass@1 by up to 12.9%, consistently outperforming SOTA code generation methods in all settings. Our code is available at https://github.com/magic-YuanTian/Selective-Prompt-Anchoring.