论文检索

Theory · Domain Adaptation and Transfer Learning

Yongyi Su, Yushu Li, Nanqing Liu, Kui Jia, xulei yang, Chuan Sheng Foo, Xun Xu

Test-time adaptation (TTA) updates the model weights during the inference stage using testing data to enhance generalization. However, this practice exposes TTA to adversarial risks. Existing studies have shown that when TTA is updated with crafted adversarial test samples, also known as test-time poisoned data, the performance on benign samples can deteriorate. Nonetheless, the perceived adversarial risk may be overstated if the poisoned data is generated under overly strong assumptions. In this work, we first review realistic assumptions for test-time data poisoning, including white-box versus grey-box attacks, access to benign data, attack order, and more. We then propose an effective and realistic attack method that better produces poisoned samples without access to benign samples, and derive an effective in-distribution attack objective. We also design two TTA-aware attack objectives. Our benchmarks of existing attack methods reveal that the TTA methods are more robust than previously believed. In addition, we analyze effective defense strategies to help develop adversarially robust TTA methods. The source code is available at https://github.com/Gorilla-Lab-SCUT/RTTDP.

Deep Learning · Generative Models and Autoencoders

Xiaofeng Yang, Cheng Chen, xulei yang, Fayao Liu, Guosheng Lin

Large-scale diffusion models have achieved remarkable performance in generative tasks. Beyond their initial training applications, these models have proven their ability to function as versatile plug-and-play priors. For instance, 2D diffusion models can serve as loss functions to optimize 3D implicit models. Rectified Flow, a novel class of generative models, has demonstrated superior performance across various domains. Compared to diffusion-based methods, rectified flow approaches surpass them in terms of generation quality and efficiency. In this work, we present theoretical and experimental evidence demonstrating that rectified flow based methods offer similar functionalities to diffusion models — they can also serve as effective priors. Besides the generative capabilities of diffusion priors, motivated by the unique time-symmetry properties of rectified flow models, a variant of our method can additionally perform image inversion. Experimentally, our rectified flow based priors outperform their diffusion counterparts — the SDS and VSD losses — in text-to-3D generation. Our method also displays competitive performance in image inversion and editing. Code is available at: https://github.com/yangxiaofeng/rectified_flow_prior.

Applications · Computer Vision

Hritik Bansal, Zongyu Lin, Tianyi Xie, Zeshun Zong, Michal Yarom, Yonatan Bitton, Chenfanfu Jiang, Yizhou Sun, Kai-Wei Chang, Aditya Grover

Recent advances in internet-scale video data pretraining have led to the development of text-to-video generative models that can create high-quality videos across a broad range of visual concepts, synthesize realistic motions and render complex objects. Hence, these generative models have the potential to become general-purpose simulators of the physical world. However, it is unclear how far we are from this goal with the existing text-to-video generative models. To this end, we present VideoPhy, a benchmark designed to assess whether the generated videos follow physical commonsense for real-world activities (e.g. marbles will roll down when placed on a slanted surface). Specifically, we curate diverse prompts that involve interactions between various material types in the physical world (e.g., solid-solid, solid-fluid, fluid-fluid). We then generate videos conditioned on these captions from diverse state-of-the-art text-to-video generative models, including open models (e.g., CogVideoX) and closed models (e.g., Lumiere, Dream Machine). Our human evaluation reveals that the existing models severely lack the ability to generate videos adhering to the given text prompts, while also lack physical commonsense. Specifically, the best performing model, CogVideoX-5B, generates videos that adhere to the caption and physical laws for 39.6% of the instances. VideoPhy thus highlights that the video generative models are far from accurately simulating the physical world. Finally, we propose an auto-evaluator, VideoCon-Physics, to assess the performance reliably for the newly released models. The code is available here: https://github.com/Hritikbansal/videophy.

Deep Learning · Large Language Models

Chongjie Si, Xuehui Wang, Xue Yang, Zhengqin Xu, Qingyun Li, Jifeng Dai, Yu Qiao, Xiaokang Yang, Wei Shen

Adapting pre-trained foundation models for various downstream tasks has been prevalent in artificial intelligence. Due to the vast number of tasks and high costs, adjusting all parameters becomes unfeasible. To mitigate this, several fine-tuning techniques have been developed to update the pre-trained model weights in a more resource-efficient manner, such as through low-rank adjustments. Yet, almost all of these methods focus on linear weights, neglecting the intricacies of parameter spaces in higher dimensions like 4D. Alternatively, some methods can be adapted for high-dimensional parameter space by compressing changes in the original space into two dimensions and then employing low-rank matrix adaptations. However, these approaches destructs the structural integrity of the involved high-dimensional spaces. To tackle the diversity of dimensional spaces across different foundation models and provide a more precise representation of the changes within these spaces, this paper introduces a generalized parameter-efficient fine-tuning framework, designed for various dimensional parameter space. Specifically, our method asserts that changes in each dimensional parameter space are based on a low-rank core space which maintains the consistent topological structure with the original space. It then models the changes through this core space alongside corresponding weights to reconstruct alterations in the original space. It effectively preserves the structural integrity of the change of original N-dimensional parameter space, meanwhile models it via low-rank tensor adaptation. Extensive experiments on computer vision, natural language processing and multi-modal tasks validate the effectiveness of our method.

Miscellaneous Aspects of Machine Learning · General Machine Learning Techniques

Chengyi Cai, Zesheng Ye, Lei Feng, Jianzhong Qi, Feng Liu

*Visual reprogramming* (VR) reuses pre-trained vision models for downstream image classification tasks by adding trainable noise patterns to inputs. When applied to vision-language models (e.g., CLIP), existing VR approaches follow the same pipeline used in vision models (e.g., ResNet, ViT), where ground-truth class labels are inserted into fixed text templates to guide the optimization of VR patterns. This label-based approach, however, overlooks the rich information and diverse attribute-guided textual representations that CLIP can exploit, which may lead to the misclassification of samples. In this paper, we propose ***Attr**ibute-based **V**isual **R**eprogramming* (AttrVR) for CLIP, utilizing ***des**criptive **attr**ibutes* (DesAttrs) and ***dist**inctive **attr**ibutes* (DistAttrs), which respectively represent common and unique feature descriptions for different classes. Besides, as images of the same class may reflect different attributes after VR, AttrVR iteratively refines patterns using the $k$-nearest DesAttrs and DistAttrs for each image sample, enabling more dynamic and sample-specific optimization. Theoretically, AttrVR is shown to reduce intra-class variance and increase inter-class separation. Empirically, it achieves superior performance in 12 downstream tasks for both ViT-based and ResNet-based CLIP. The success of AttrVR facilitates more effective integration of VR from unimodal vision models into vision-language models. Our code is available at https://github.com/tmlr-group/AttrVR.

Deep Learning · Large Language Models

XIANGYU PENG, Congying Xia, Xinyi Yang, Caiming Xiong, Chien-Sheng Wu, Chen Xing

Post-training Large Language Models (LLMs) with explicit reasoning trajectories can enhance their reasoning abilities. However, acquiring such high-quality trajectory data typically demands meticulous supervision from humans or superior models, which can be either expensive or license-constrained. In this paper, we explore how far an LLM can improve its reasoning by self-synthesizing reasoning paths as training data without any additional supervision. Existing self-synthesizing methods, such as STaR, suffer from poor generalization to out-of-domain (OOD) reasoning tasks. We hypothesize it is due to that their self-synthesized reasoning paths are too task-specific, lacking general task-agnostic reasoning guidance. To address this, we propose **Reasoning Generalist via Self-Improvement (ReGenesis)**, a method to *self-synthesize reasoning paths as post-training data by progressing from abstract to concrete*. More specifically, ReGenesis self-synthesizes reasoning paths by converting general reasoning guidelines into task-specific ones, generating reasoning structures, and subsequently transforming these structures into reasoning paths, without the need for human-designed task-specific examples used in existing methods. We show that ReGenesis achieves superior performance on all in-domain and OOD settings tested compared to existing methods. For six OOD tasks specifically, while previous methods exhibited an average performance decrease of approximately 4.6% after post training, ReGenesis delivers around 6.1% performance improvement. We also conduct an in-depth analysis of our framework and show ReGenesis is effective across various language models and design choices.

Deep Learning · Generative Models and Autoencoders

Dawit Mureja Argaw, Xian Liu, Qinsheng Zhang, Joon Son Chung, Ming-Yu Liu, Fitsum Reda

Generative modeling has seen significant advancements in image and video synthesis. However, the curse of dimensionality remains a significant obstacle, especially for video generation, given its inherently complex and high-dimensional nature. Many existing works rely on low-dimensional latent spaces from pretrained image autoencoders. However, this approach overlooks temporal redundancy in videos and often leads to temporally incoherent decoding. To address this issue, we propose a video compression network that reduces the dimensionality of visual data both spatially and temporally. Our model, based on a variational autoencoder, employs causal 3D convolution to handle images and videos jointly. The key contributions of our work include a scale-agnostic encoder for preserving video fidelity, a novel spatio-temporal down/upsampling block for robust long-sequence modeling, and a flow regularization loss for accurate motion decoding. Our approach outperforms competitors in video quality and compression rates across various datasets. Experimental analyses also highlight its potential as a robust autoencoder for video generation training.

Applications · Computer Vision

Sha Guo, Jing Chen, Zixuan Hu, Zhuo Chen, Wenhan Yang, Yu Lin, Xing Jiang, LINGYU DUAN

Conventional image compression methods are inadequate for intelligent analysis, as they overemphasize pixel-level precision while neglecting semantic significance and the interaction among multiple tasks. This paper introduces a Taskonomy-Aware Multi-Task Compression framework comprising (1) inter-coherent task grouping, which organizes synergistic tasks into shared representations to improve multi-task accuracy and reduce encoding volume, and (2) a conditional entropy-based directed acyclic graph (DAG) that captures causal dependencies among grouped representations. By leveraging parent representations as contextual priors for child representations, the framework effectively utilizes cross-task information to improve entropy model accuracy. Experiments on diverse vision tasks, including Keypoint 2D, Depth Z-buffer, Semantic Segmentation, Surface Normal, Edge Texture, and Autoencoder, demonstrate significant bitrate-performance gains, validating the method’s capability to reduce system entropy uncertainty. These findings underscore the potential of leveraging representation disentanglement, synergy, and causal modeling to learn compact representations, which enable efficient multi-task compression in intelligent systems.

Optimization · Large Scale, Parallel and Distributed

Zesen Wang, Jiaojiao Zhang, Xuyang Wu, Mikael Johansson

Decentralized training of deep neural networks has attracted significant attention for its theoretically superior scalability compared to synchronous data-parallel methods like All-Reduce. However, realizing this potential in multi-node training is challenging due to the complex design space that involves communication topologies, computation patterns, and optimization algorithms. This paper identifies three key factors that can lead to speedups over All-Reduce training and constructs a runtime model to determine when and how decentralization can shorten the per-iteration runtimes. To support the decentralized training of transformer-based models, we introduce a decentralized Adam algorithm that overlaps communications with computations, prove its convergence, and propose an accumulation technique to mitigate the high variance caused by small local batch sizes. We deploy our solution in clusters with up to 64 GPUs, demonstrating its practical advantages in both runtime and generalization performance under a fixed iteration budget.The experiment code is open-source at [https://github.com/WangZesen/Decentralized-Training-Exp](https://github.com/WangZesen/Decentralized-Training-Exp), and the extension code is open-source at [https://github.com/WangZesen/Decent-DP](https://github.com/WangZesen/Decent-DP).

Social Aspects · Trustworthy Machine Learning

Ching-Yun Ko, Pin-Yu Chen, Payel Das, Youssef Mroueh, Soham Dan, Georgios Kollias, Subhajit Chaudhury, Tejaswini Pedapati, Luca Daniel

Reducing the likelihood of generating harmful and toxic output is an essential task when aligning large language models (LLMs). Existing methods mainly rely on training an external reward model (i.e., another language model) or fine-tuning the LLM using self-generated data to influence the outcome. In this paper, we show that LLMs have the capability of self-detoxification without external reward model learning or retraining of the LM. We propose \textit{Self-disciplined Autoregressive Sampling (SASA)}, a lightweight controlled decoding algorithm for toxicity reduction of LLMs. SASA leverages the contextual representations from an LLM to learn linear subspaces from labeled data characterizing toxic v.s. non-toxic output in analytical forms. When auto-completing a response token-by-token, SASA dynamically tracks the margin of the current output to steer the generation away from the toxic subspace, by adjusting the autoregressive sampling strategy. Evaluated on LLMs of different scale and nature, namely Llama-3.1-Instruct (8B), Llama-2 (7B), and GPT2-L models with the RealToxicityPrompts, BOLD, and AttaQ benchmarks, SASA markedly enhances the quality of the generated sentences relative to the original models and attains comparable performance to state-of-the-art detoxification techniques, significantly reducing the toxicity level by only using the LLM's internal representations.

Guibin Zhang, Yiyan Qi, Ziyang Cheng, Yanwei Yue, Dawei Cheng, Jian Guo

Graph data augmentation (GDA) has shown significant promise in enhancing the performance, generalization, and robustness of graph neural networks (GNNs). However, contemporary methodologies are often limited to static graphs, whose applicability on dynamic graphs—more prevalent in real-world applications—remains unexamined. In this paper, we empirically highlight the challenges faced by static GDA methods when applied to dynamic graphs, particularly their inability to maintain temporal consistency. In light of this limitation, we propose a dedicated augmentation framework for dynamic graphs, termed $\texttt{DyAug}$, which adaptively augments the evolving graph structure with temporal consistency awareness. Specifically, we introduce the paradigm of graph rationalization for dynamic GNNs, progressively distinguishing between causal subgraphs (\textit{rationale}) and the non-causal complement (\textit{environment}) across snapshots. We develop three types of environment replacement, including, spatial, temporal, and spatial-temporal, to facilitate data augmentation in the latent representation space, thereby improving the performance, generalization, and robustness of dynamic GNNs. Extensive experiments on six benchmarks and three GNN backbones demonstrate that $\texttt{DyAug}$ can \textbf{(I)} improve the performance of dynamic GNNs by $0.89\\%\sim3.13\\%\uparrow$; \textbf{(II)} effectively counter targeted and non-targeted adversarial attacks with $6.2\\%\sim12.2\\%\\uparrow$ performance boost; \textbf{(III)} make stable predictions under temporal distribution shifts.

Applications · Robotics

Matthew Chang, Gunjan Chhablani, Alexander Clegg, Mikael Dallaire Cote, Ruta Desai, Michal Hlavac, Vladimir Karashchuk, Jacob Krantz, Roozbeh Mottaghi, Priyam Parashar 等

We present a benchmark for Planning And Reasoning Tasks in humaN-Robot collaboration (PARTNR) designed to study human-robot coordination in household activities. PARTNR tasks exhibit characteristics of everyday tasks, such as spatial, temporal, and heterogeneous agent capability constraints. We employ a semi-automated task generation pipeline using Large Language Models (LLMs), incorporating simulation-in-the-loop for the grounding and verification. PARTNR stands as the largest benchmark of its kind, comprising 100,000 natural language tasks, spanning 60 houses and 5,819 unique objects. We analyze state-of-the-art LLMs on PARTNR tasks, across the axes of planning, perception and skill execution. The analysis reveals significant limitations in SoTA models, such as poor coordination and failures in task tracking and recovery from errors. When LLMs are paired with 'real' humans, they require 1.5x as many steps as two humans collaborating and 1.1x more steps than a single human, underscoring the potential for improvement in these models. We further show that fine-tuning smaller LLMs with planning data can achieve performance on par with models 9 times larger, while being 8.6x faster at inference. Overall, PARTNR highlights significant challenges facing collaborative embodied agents and aims to drive research in this direction.

Deep Learning · Large Language Models

Ayush Kaushal, Tejas Vaidhya, Arnab Mondal, Tejas Pandey, Aaryan Bhagat, Irina Rish

Rapid advancements in GPU computational power has outpaced memory capacity and bandwidth growth, creating bottlenecks in Large Language Model (LLM) inference. Post-training quantization is the leading method for addressing memory-related bottlenecks in LLM inference, but it suffers from significant performance degradation below 4-bit precision. This paper addresses these challenges by investigating the pretraining of low-bitwidth models specifically Ternary Language Models (TriLMs) as an alternative to traditional floating-point models (FloatLMs) and their post-training quantized versions (QuantLMs). We present Spectra LLM suite, the first open suite of LLMs spanning multiple bit-widths, including FloatLMs, QuantLMs, and TriLMs, ranging from 99M to 3.9B parameters trained on 300B tokens. Our comprehensive evaluation demonstrates that TriLMs offer superior scaling behavior in terms of model size (in bits). Surprisingly, at scales exceeding one billion parameters, TriLMs consistently outperform their QuantLM and FloatLM counterparts for a given bit size across various benchmarks. Notably, the 3.9B parameter TriLM matches the performance of the FloatLM 3.9B across all benchmarks, despite having fewer bits than FloatLM 830M. Overall, this research provides valuable insights into the feasibility and scalability of low-bitwidth language models, paving the way for the development of more efficient LLMs.

Jun Shern Chan, Neil Chowdhury, Oliver Jaffe, James Aung, Dane Sherburn, Evan Mays, Giulio Starace, Kevin Liu, Leon Maksin, Tejal Patwardhan 等

We introduce MLE-bench, a benchmark for measuring how well AI agents perform at machine learning engineering. To this end, we curate 75 ML engineering-related competitions from Kaggle, creating a diverse set of challenging tasks that test real-world ML engineering skills such as training models, preparing datasets, and running experiments. We establish human baselines for each competition using Kaggle's publicly available leaderboards. We use open-source agent scaffolds to evaluate several frontier language models on our benchmark, finding that the best-performing setup — OpenAI's o1-preview with AIDE scaffolding — achieves at least the level of a Kaggle bronze medal in 16.9% of competitions. In addition to our main results, we investigate various forms of resource-scaling for AI agents and the impact of contamination from pre-training. We open-source our benchmark code https://github.com/openai/mle-bench to facilitate future research in understanding the ML engineering capabilities of AI agents.

Deep Learning · Everything Else

Jun Shern Chan, Neil Chowdhury, Oliver Jaffe, James Aung, Dane Sherburn, Evan Mays, Giulio Starace, Kevin Liu, Leon Maksin, Tejal Patwardhan 等

We introduce MLE-bench, a benchmark for measuring how well AI agents perform at machine learning engineering. To this end, we curate 75 ML engineering-related competitions from Kaggle, creating a diverse set of challenging tasks that test real-world ML engineering skills such as training models, preparing datasets, and running experiments. We establish human baselines for each competition using Kaggle's publicly available leaderboards. We use open-source agent scaffolds to evaluate several frontier language models on our benchmark, finding that the best-performing setup — OpenAI's o1-preview with AIDE scaffolding — achieves at least the level of a Kaggle bronze medal in 16.9% of competitions. In addition to our main results, we investigate various forms of resource-scaling for AI agents and the impact of contamination from pre-training. We open-source our benchmark code https://github.com/openai/mle-bench to facilitate future research in understanding the ML engineering capabilities of AI agents.

Deep Learning · Generative Models and Autoencoders

Zeqi Xiao, Wenqi Ouyang, Yifan Zhou, Shuai Yang, Lei Yang, Jianlou Si, Xingang Pan

Recent advancements in video generation have been greatly driven by video diffusion models, with camera motion control emerging as a crucial challenge in creating view-customized visual content. This paper introduces trajectory attention, a novel approach that performs attention along available pixel trajectories for fine-grained camera motion control. Unlike existing methods that often yield imprecise outputs or neglect temporal correlations, our approach possesses a stronger inductive bias that seamlessly injects trajectory information into the video generation process. Importantly, our approach models trajectory attention as an auxiliary branch alongside traditional temporal attention. This design enables the original temporal attention and the trajectory attention to work in synergy, ensuring bothprecise motion control and new content generation capability, which is critical when the trajectory is only partially available. Experiments on camera motion control for images and videos demonstrate significant improvements in precision and long-range consistency while maintaining high-quality generation. Furthermore, we show that our approach can be extended to other video motion control tasks, such as first-frame-guided video editing, where it excels in maintaining content consistency over large spatial and temporal ranges.

Applications · Computer Vision

Fanqing Meng, Jin Wang, Chuanhao Li, Quanfeng Lu, Hao Tian, Tianshuo Yang, Jiaqi Liao, Xizhou Zhu, Jifeng Dai, Yu Qiao 等

The capability to process multiple images is crucial for Large Vision-Language Models (LVLMs) to develop a more thorough and nuanced understanding of a scene. Recent multi-image LVLMs have begun to address this need. However, their evaluation has not kept pace with their development. To fill this gap, we introduce the Multimodal Multi-image Understanding (MMIU) benchmark, a comprehensive evaluation suite designed to assess LVLMs across a wide range of multi-image tasks. MMIU encompasses 7 types of multi-image relationships, 52 tasks, 77K images, and 11K meticulously curated multiple-choice questions, making it the most extensive benchmark of its kind. Our evaluation of nearly 30 popular LVLMs, including both open-source and proprietary models, reveals significant challenges in multi-image comprehension, particularly in tasks involving spatial understanding. Even the most advanced models, such as GPT-4o, achieve only 55.7\% accuracy on MMIU. Through multi-faceted analytical experiments, we identify key performance gaps and limitations, providing valuable insights for future model and data improvements. We aim for MMIU to advance the frontier of LVLM research and development. We release the data and code at https://github.com/MMIUBenchmark/MMIU.

Applications · Chemistry and Drug Discovery

Hansi Yang, Quanming Yao, James Kwok

Despite their wide application across various fields, current molecular property prediction models struggle with the challenge of activity cliff, which refers to the situation where molecules with similar chemical structures display remarkable different properties. This phenomenon hinders existing models' ability to learn distinctive representations for molecules with similar chemical structures, and results in inaccurate predictions on molecules with activity cliff. To address this limitation, we first present empirical evidence demonstrating the ineffectiveness of standard training pipelines on molecules with activity cliff. We propose a novel approach that reformulates molecular property prediction as a node classification problem, introducing two innovative tasks at both the node and edge levels to improve learning outcomes for these challenging molecules with activity cliff. Our method is versatile, allowing seamless integration with a variety of base models, whether pre-trained or randomly initialized. Extensive evaluation across different molecular property prediction datasets validate the effectiveness of our approach.

Deep Learning · Large Language Models

Anish Mudide, Josh Engels, Eric Michaud, Max Tegmark, Christian Schroeder de Witt

Sparse autoencoders (SAEs) are a recent technique for decomposing neural network activations into human-interpretable features. However, in order for SAEs to identify all features represented in frontier models, it will be necessary to scale them up to very high width, posing a computational challenge. In this work, we introduce Switch Sparse Autoencoders, a novel SAE architecture aimed at reducing the compute cost of training SAEs. Inspired by sparse mixture of experts models, Switch SAEs route activation vectors between smaller "expert" SAEs, enabling SAEs to efficiently scale to many more features. We present experiments comparing Switch SAEs with other SAE architectures, and find that Switch SAEs deliver a substantial Pareto improvement in the reconstruction vs. sparsity frontier for a given fixed training compute budget. We also study the geometry of features across experts, analyze features duplicated across experts, and verify that Switch SAE features are as interpretable as features found by other SAE architectures.

Theory · Learning Theory

Changlong Wu, Ananth Grama, Wojciech Szpankowski

Generative models have shown impressive capabilities in synthesizing high-quality outputs across various domains. However, a persistent challenge is the occurrence of "hallucinations," where the model produces outputs that are not grounded in the underlying facts. While empirical strategies have been explored to mitigate this issue, a rigorous theoretical understanding remains elusive. In this paper, we develop a theoretical framework to analyze the *learnability* of non-hallucinating generative models from a learning-theoretic perspective. Our results reveal that non-hallucinating learning is statistically *impossible* when relying solely on the training dataset, even for a hypothesis class of size two and when the entire training set is truthful. To overcome these limitations, we show that incorporating *inductive biases* aligned with the actual facts into the learning process is essential. We provide a systematic approach to achieve this by restricting the fact set to a concept class of finite VC-dimension and demonstrate its effectiveness under various learning paradigms. Although our findings are primarily conceptual, they represent a first step towards a principled approach to addressing hallucinations in learning generative models.