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Deep Learning · Everything Else

Zixuan Xiong, Guangwei Xu, wenkai zhang, Yuan Miao, Xuan Wu, LinHai, Ruijie Guo, Hai-Tao Zheng

With the explosive growth of video content, video captions have emerged as a crucial tool for video comprehension, significantly enhancing the ability to understand and retrieve information from videos. However, most publicly available dense video captioning datasets are in English, resulting in a scarcity of large-scale and high-quality Chinese dense video captioning datasets. To address this gap within the Chinese community and to promote the advancement of Chinese multi-modal models, we develop the first, large-scale, and high-quality Chinese dense video captioning dataset, named Youku Dense Caption. This dataset is sourced from Youku, a prominent Chinese video-sharing website. Youku Dense Caption includes 31,466 complete short videos annotated by 311,921 Chinese captions. To the best of our knowledge, it is currently the largest publicly available dataset for fine-grained Chinese video descriptions. Additionally, we establish several benchmarks for Chinese video-language tasks based on the Youku Dense Caption, including retrieval, grounding, and generation tasks. Extensive experiments and evaluations are conducted on existing state-of-the-art multi-modal models, demonstrating the dataset's utility and the potential for further research.

Anne Gagneux, Ségolène Martin, Rémi Emonet, Quentin Bertrand, Mathurin Massias

Conditional flow matching was introduced by three simultaneous papers at ICLR 2023, through different approaches (conditional matching, rectifying flows and stochastic interpolants). In this blog post, we provide self-contained explanations and visualizations to understand standard flow techniques (Part 1) and conditional flow matching (Part 2). In addition we provide insights to grab new intuition on conditional flow matching (Part 3) .

Deep Learning · Generative Models and Autoencoders

Nicolas Zilberstein, Morteza Mardani, Santiago Segarra

Score Distillation Sampling (SDS) has been pivotal for leveraging pre-trained diffusion models in downstream tasks such as inverse problems, but it faces two major challenges: $(i)$ mode collapse and $(ii)$ latent space inversion, which become more pronounced in high-dimensional data. To address mode collapse, we introduce a novel variational framework for posterior sampling. Utilizing the Wasserstein gradient flow interpretation of SDS, we propose a multimodal variational approximation with a \emph{repulsion} mechanism that promotes diversity among particles by penalizing pairwise kernel-based similarity. This repulsion acts as a simple regularizer, encouraging a more diverse set of solutions. To mitigate latent space ambiguity, we extend this framework with an \emph{augmented} variational distribution that disentangles the latent and data. This repulsive augmented formulation balances computational efficiency, quality, and diversity. Extensive experiments on linear and nonlinear inverse tasks with high-resolution images ($512 \times 512$) using pre-trained Stable Diffusion models demonstrate the effectiveness of our approach.

Optimization · Large Scale, Parallel and Distributed

Demyan Yarmoshik, Alexander Rogozin, Nikita Kiselev, Daniil Dorin, Alexander Gasnikov, Dmitry Kovalev

We consider the decentralized minimization of a separable objective $\sum_{i=1}^{n} f_i(x_i)$, where the variables are coupled through an affine constraint $\sum_{i=1}^n\left(\mathbf{A}_i x_i - b_i\right) = 0$.We assume that the functions $f_i$, matrices $\mathbf{A}_i$, and vectors $b_i$ are stored locally by the nodes of a computational network, and that the functions $f_i$ are smooth and strongly convex. This problem has significant applications in resource allocation and systems control and can also arise in distributed machine learning.We propose lower complexity bounds for decentralized optimization problems with coupled constraints and a first-order algorithm achieving the lower bounds. To the best of our knowledge, our method is also the first linearly convergent first-order decentralized algorithm for problems with general affine coupled constraints.

Yu Feng, Ben Zhou, Weidong Lin, Dan Roth

Predictive models often need to work with incomplete information in real-world tasks. Consequently, they must provide reliable probability or confidence estimation, especially in large-scale decision-making and planning tasks. Current large language models (LLMs) are insufficient for accurate estimations, but they can generate relevant factors that may affect the probabilities, produce coarse-grained probabilities when the information is more complete, and help determine which factors are relevant to specific downstream contexts. In this paper, we make use of these capabilities of LLMs to provide a significantly more accurate probabilistic estimation. We propose BIRD, a novel probabilistic inference framework that aligns a Bayesian network with LLM abductions and then estimates more accurate probabilities in a deduction step. We show BIRD provides reliable probability estimations that are 30% better than those provided directly by LLM baselines. These estimates further contribute to better and more trustworthy decision making.

Applications · Computer Vision

Tianyuan Zhang, Zhengfei Kuang, Haian Jin, Zexiang Xu, Sai Bi, Hao Tan, HE Zhang, Yiwei Hu, Milos Hasan, William Freeman 等

We propose RelitLRM, a Large Reconstruction Model (LRM) for generating high-quality Gaussian splatting representations of 3D objects under novel illuminations from sparse (4-8) posed images captured under unknown static lighting. Unlike prior inverse rendering methods requiring dense captures and slow optimization, often causing artifacts like incorrect highlights or shadow baking, RelitLRM adopts a feed-forward transformer-based model with a novel combination of a geometry reconstructor and a relightable appearance generator based on diffusion. The model is trained end-to-end on synthetic multi-view renderings of objects under varying known illuminations. This architecture design enables to effectively decompose geometry and appearance, resolve the ambiguity between material and lighting, and capture the multi-modal distribution of shadows and specularity in the relit appearance. We show our sparse-view feed-forward RelitLRM offers competitive relighting results to state-of-the-art dense-view optimization-based baselines while being significantly faster. Our project page is available at: https://relit-lrm.github.io/.

Applications · Physics

Apivich Hemachandra, Gregory Kang Ruey Lau, See-Kiong Ng, Bryan Kian Hsiang Low

In many science and engineering settings, system dynamics are characterized by governing partial differential equations (PDEs), and a major challenge is to solve inverse problems (IPs) where unknown PDE parameters are inferred based on observational data gathered under limited budget. Due to the high costs of setting up and running experiments, experimental design (ED) is often done with the help of PDE simulations to optimize for the most informative design parameters (e.g., sensor placements) to solve such IPs, prior to actual data collection. This process of optimizing design parameters is especially critical when the budget and other practical constraints make it infeasible to adjust the design parameters between trials during the experiments.However, existing experimental design (ED) methods tend to require sequential and frequent design parameter adjustments between trials. Furthermore, they also have significant computational bottlenecks due to the need for complex numerical simulations for PDEs, and do not exploit the advantages provided by physics informed neural networks (PINNs) in solving IPs for PDE-governed systems, such as its meshless solutions, differentiability, and amortized training. This work presents Physics-Informed Experimental Design (PIED), the first ED framework that makes use of PINNs in a fully differentiable architecture to perform continuous optimization of design parameters for IPs for one-shot deployments. PIED overcomes existing methods' computational bottlenecks through parallelized computation and meta-learning of PINN parameter initialization, and proposes novel methods to effectively take into account PINN training dynamics in optimizing the ED parameters. Through experiments based on noisy simulated data and even real world experimental data, we empirically show that given limited observation budget, PIED significantly outperforms existing ED methods in solving IPs, including for challenging settings where the inverse parameters are unknown functions rather than just finite-dimensional.

Deep Learning · Robustness

Brian Formento, Chuan Sheng Foo, See-Kiong Ng

A fundamental issue in deep learning has been adversarial robustness. As these systems have scaled, such issues have persisted. Currently, large language models (LLMs) with billions of parameters suffer from adversarial attacks just like their earlier, smaller counterparts. However, the threat models have changed. Previously, having gray-box access, where input embeddings or output logits/probabilities were visible to the user, might have been reasonable. However, with the introduction of closed-source models, no information about the model is available apart from the generated output. This means that current black-box attacks can only utilize the final prediction to detect if an attack is successful. In this work, we investigate and demonstrate the potential of attack guidance, akin to using output probabilities, while having only black-box access in a classification setting. This is achieved through the ability to elicit confidence from the model. We empirically show that the elicited confidence is calibrated and not hallucinated for current LLMs. By minimizing the elicited confidence, we can therefore increase the likelihood of misclassification. Our new proposed paradigm demonstrates promising state-of-the-art results on three datasets across two models (LLaMA-3-8B-Instruct and Mistral-7B-Instruct-V0.3) when comparing our technique to existing hard-label black-box attack methods that introduce word-level substitutions. The code is publicly available at GitHub: Confidence_Elicitation_Attacks.

Reinforcement Learning · Batch/Offline

Hai Zhang, Boyuan Zheng, Tianying Ji, Jinhang Liu, Anqi Guo, Junqiao Zhao, Lanqing Li

Offline meta reinforcement learning (OMRL) has emerged as a promising approach for interaction avoidance and strong generalization performance by leveraging pre-collected data and meta-learning techniques. Previous context-based approaches predominantly rely on the intuition that alternating optimization between the context encoder and the policy can lead to performance improvements, as long as the context encoder follows the principle of maximizing the mutual information between the task variable $M$ and its latent representation $Z$ ($I(Z;M)$) while the policy adopts the standard offline reinforcement learning (RL) algorithms conditioning on the learned task representation.Despite promising results, the theoretical justification of performance improvements for such intuition remains underexplored.Inspired by the return discrepancy scheme in the model-based RL field, we find that the previous optimization framework can be linked with the general RL objective of maximizing the expected return, thereby explaining performance improvements. Furthermore, after scrutinizing this optimization framework, we observe that the condition for monotonic performance improvements does not consider the variation of the task representation. When these variations are considered, the previously established condition may no longer be sufficient to ensure monotonicity, thereby impairing the optimization process.We name this issue \underline{task representation shift} and theoretically prove that the monotonic performance improvements can be guaranteed with appropriate context encoder updates.We use different settings to rein in the task representation shift on three widely adopted training objectives concerning maximizing $I(Z;M)$ across different data qualities.Empirical results show that reining in the task representation shift can indeed improve performance.Our work opens up a new avenue for OMRL, leading to a better understanding between the task representation and performance improvements.

Jiashuo Liu, Nabeel Seedat, Peng Cui, Mihaela van der Schaar

Distribution shifts in time-series data are complex due to temporal dependencies, multivariable interactions, and trend changes. However, robust methods often rely on structural assumptions that lack thorough empirical validation, limiting their practical applicability. In order to support an empirically grounded inductive approach to research, we introduce our **T**ime-**S**eries **S**hift **A**ttribution (TSSA) framework, which analyzes *problem-specific* patterns of distribution shifts. Our framework attributes performance degradation from various types of shifts to each *temporal data property* in a detailed manner, supported by theoretical analysis of unbiasedness and asymptotic properties. Empirical studies in real-world healthcare applications highlight how the TSSA framework enhances the understanding of time-series shifts, facilitating reliable model deployment and driving targeted improvements from both algorithmic and data-centric perspectives.

Deep Learning · Large Language Models

Boyu Gou, Demi Ruohan Wang, Boyuan Zheng, Yanan Xie, Cheng Chang, Yiheng Shu, Huan Sun, Yu Su

Multimodal large language models (MLLMs) are transforming the capabilities of graphical user interface (GUI) agents, facilitating their transition from controlled simulations to complex, real-world applications across various platforms. However, the effectiveness of these agents hinges on the robustness of their grounding capability. Current GUI agents predominantly utilize text-based representations such as HTML or accessibility trees, which, despite their utility, often introduce noise, incompleteness, and increased computational overhead. In this paper, we advocate a human-like embodiment for GUI agents that perceive the environment entirely visually and directly perform pixel-level operations on the GUI. The key is visual grounding models that can accurately map diverse referring expressions of GUI elements to their coordinates on the GUI across different platforms. We show that a simple recipe, which includes web-based synthetic data and slight adaptation of the LLaVA architecture, is surprisingly effective for training such visual grounding models. We collect the largest dataset for GUI visual grounding so far, containing 10M GUI elements and their referring expressions over 1.3M screenshots, and use it to train UGround, a strong universal visual grounding model for GUI agents. Empirical results on six benchmarks spanning three categories (grounding, offline agent, and online agent) show that 1) UGround substantially outperforms existing visual grounding models for GUI agents, by up to 20\% absolute, and 2) agents with UGround outperform state-of-the-art agents, despite the fact that existing agents use additional text-based input while ours only uses visual perception. These results provide strong support for the feasibility and promises of GUI agents that navigate the digital world as humans do.

Deep Learning · Large Language Models

Boyu Gou, Demi Ruohan Wang, Boyuan Zheng, Yanan Xie, Cheng Chang, Yiheng Shu, Huan Sun, Yu Su

Multimodal large language models (MLLMs) are transforming the capabilities of graphical user interface (GUI) agents, facilitating their transition from controlled simulations to complex, real-world applications across various platforms. However, the effectiveness of these agents hinges on the robustness of their grounding capability. Current GUI agents predominantly utilize text-based representations such as HTML or accessibility trees, which, despite their utility, often introduce noise, incompleteness, and increased computational overhead. In this paper, we advocate a human-like embodiment for GUI agents that perceive the environment entirely visually and directly perform pixel-level operations on the GUI. The key is visual grounding models that can accurately map diverse referring expressions of GUI elements to their coordinates on the GUI across different platforms. We show that a simple recipe, which includes web-based synthetic data and slight adaptation of the LLaVA architecture, is surprisingly effective for training such visual grounding models. We collect the largest dataset for GUI visual grounding so far, containing 10M GUI elements and their referring expressions over 1.3M screenshots, and use it to train UGround, a strong universal visual grounding model for GUI agents. Empirical results on six benchmarks spanning three categories (grounding, offline agent, and online agent) show that 1) UGround substantially outperforms existing visual grounding models for GUI agents, by up to 20\% absolute, and 2) agents with UGround outperform state-of-the-art agents, despite the fact that existing agents use additional text-based input while ours only uses visual perception. These results provide strong support for the feasibility and promises of GUI agents that navigate the digital world as humans do.

Deep Learning · Large Language Models

Mengqi Liao, Wei Chen, Junfeng Shen, Shengnan Guo, Huaiyu Wan

Recent studies have combined Mixture of Experts (MoE) and Parameter-Efficient Fine-tuning (PEFT) to fine-tune large language models (LLMs), holding excellent performance in multi-task scenarios while remaining resource-efficient. However, existing MoE approaches still exhibit the following limitations: (1) Current methods fail to consider that different LLM layers capture features at varying levels of granularity, leading to suboptimal performance. (2) Task-level routing methods lack generalizability to unseen tasks. (3) The uncertainty introduced by load imbalance loss undermines the effective specialization of the experts. To address these challenges, we propose HMoRA, a Hierarchical fine-tuning method that combines MoE and LoRA, employing hybrid routing that integrates token-level and task-level routing in a hierarchical manner. This hierarchical hybrid routing allows the model to more efficiently capture both fine-grained token information and broader task contexts. To improve the certainty of expert selection, a novel routing auxiliary loss is introduced. This auxiliary function also enhances the task router's ability to differentiate tasks and its generalization to unseen tasks. Additionally, several optional lightweight designs have been proposed to significantly reduce both the number of trainable parameters and computational costs. Experimental results demonstrate that HMoRA outperforms full fine-tuning across multiple NLP benchmarks, while fine-tuning only 3.9\% of the parameters. The code is available on: https://github.com/LiaoMengqi/HMoRA.

Deep Learning · Other Representation Learning

Ningyuan Zhang, Jie Lu, Keqiuyin Li, Zhen Fang, Guangquan Zhang

Prompt Tuning adapts frozen models to new tasks by prepending a few learnable embeddings to the input.However, it struggles with tasks that suffer from data scarcity.To address this, we explore Cross-Modality Prompt Transfer, leveraging prompts pretrained on a data-rich modality to improve performance on data-scarce tasks in another modality.As a pioneering study, we first verify the feasibility of cross-modality prompt transfer by directly applying frozen source prompts (trained on the source modality) to the target modality task.To empirically study cross-modality prompt transferability, we train a linear layer to adapt source prompts to the target modality, thereby boosting performance and providing ground-truth transfer results.Regarding estimating prompt transferability, existing methods show ineffectiveness in cross-modality scenarios where the gap between source and target tasks is larger.We address this by decomposing the gap into the modality gap and the task gap, which we measure separately to autonomously select the best source prompt for a target task.Additionally, we propose Attention Transfer to further reduce the gaps by injecting target knowledge into the prompt and reorganizing a top-transferable source prompt using an attention block.We conduct extensive experiments involving prompt transfer from 13 source language tasks to 19 target vision tasks under three settings.Our findings demonstrate that:(i) cross-modality prompt transfer is feasible, supported by in-depth analysis;(ii) measuring both the modality and task gaps is crucial for accurate prompt transferability estimation, a factor overlooked by previous studies;(iii) cross-modality prompt transfer can significantly release the powers of prompt tuning on data-scarce tasks, as evidenced by comparisons with a newly released prompt-based benchmark.

Dongmin Park, Sebin Kim, Taehong Moon, Minkyu Kim, Kangwook Lee, Jaewoong Cho

State-of-the-art text-to-image (T2I) diffusion models often struggle to generate rare compositions of concepts, e.g., objects with unusual attributes. In this paper, we show that the compositional generation power of diffusion models on such rare concepts can be significantly enhanced by the Large Language Model (LLM) guidance. We start with empirical and theoretical analysis, demonstrating that exposing frequent concepts relevant to the target rare concepts during the diffusion sampling process yields more accurate concept composition. Based on this, we propose a training-free approach, R2F, that plans and executes the overall rare-to-frequent concept guidance throughout the diffusion inference by leveraging the abundant semantic knowledge in LLMs. Our framework is flexible across any pre-trained diffusion models and LLMs, and can be seamlessly integrated with the region-guided diffusion approaches. Extensive experiments on three datasets, including our newly proposed benchmark, RareBench, containing various prompts with rare compositions of concepts, R2F significantly surpasses existing models including SD3.0 and FLUX by up to 28.1%p in T2I alignment. Code is available at https://github.com/krafton-ai/Rare-to-Frequent.

Social Aspects · Trustworthy Machine Learning

Hatef Otroshi Shahreza, Sébastien Marcel

Face recognition datasets are often collected by crawling Internet and without individuals' consents, raising ethical and privacy concerns. Generating synthetic datasets for training face recognition models has emerged as a promising alternative. However, the generation of synthetic datasets remains challenging as it entails adequate inter-class and intra-class variations. While advances in generative models have made it easier to increase intra-class variations in face datasets (such as pose, illumination, etc.), generating sufficient inter-class variation is still a difficult task. In this paper, we formulate the dataset generation as a packing problem on the embedding space (represented on a hypersphere) of a face recognition model and propose a new synthetic dataset generation approach, called HyperFace. We formalize our packing problem as an optimization problem and solve it with a gradient descent-based approach. Then, we use a conditional face generator model to synthesize face images from the optimized embeddings. We use our generated datasets to train face recognition models and evaluate the trained models on several benchmarking real datasets. Our experimental results show that models trained with HyperFace achieve state-of-the-art performance in training face recognition using synthetic datasets. Project page: https://www.idiap.ch/paper/hyperface

Social Aspects · Accountability, Transparency and Interpretability

Tongtian Zhu, Wenhao Li, Can Wang, Fengxiang He

Decentralized learning offers a promising approach to crowdsource data consumptions and computational workloads across geographically distributed compute interconnected through peer-to-peer networks, accommodating the exponentially increasing demands. However, proper incentives are still in absence, considerably discouraging participation. Our vision is that a fair incentive mechanism relies on fair attribution of contributions to participating nodes, which faces non-trivial challenges arising from the localized connections making influence ``cascade'' in a decentralized network. To overcome this, we design the first method to estimate Data Influence CascadE (DICE) in a decentralized environment. Theoretically, the framework derives tractable approximations of influence cascade over arbitrary neighbor hops, suggesting the influence cascade is determined by an interplay of data, communication topology, and the curvature of loss landscape.DICE also lays the foundations for applications including selecting suitable collaborators and identifying malicious behaviors.Project page is available at https://raiden-zhu.github.io/blog/2025/DICE.

Reinforcement Learning · Deep RL

Jason Piquenot, Maxime Berar, Romain Raveaux, Pierre Héroux, Jean-Yves RAMEL, Sébastien Adam

This paper presents Grammar Reinforcement Learning (GRL), a reinforcement learning algorithm that uses Monte Carlo Tree Search (MCTS) and a transformer architecture that models a Pushdown Automaton (PDA) within a context-free grammar (CFG) framework. Taking as use case the problem of efficiently counting paths and cycles in graphs, a key challenge in network analysis, computer science, biology, and social sciences, GRL discovers new matrix-based formulas for path/cycle counting that improve computational efficiency by factors of two to six w.r.t state-of-the-art approaches. Our contributions include: (i) a framework for generating transformers that operate within a CFG, (ii) the development of GRL for optimizing formulas within grammatical structures, and (iii) the discovery of novel formulas for graph substructure counting, leading to significant computational improvements.

Probabilistic Methods · Bayesian Models and Methods

Mengjing Wu, Junyu Xuan, Jie Lu

Traditional parameter-space posterior inference for Bayesian neural networks faces several challenges, such as the difficulty in specifying meaningful prior, the potential pathologies in deep models and the intractability for multi-modal posterior. To address these issues, functional variational inference (fVI) and functional Markov Chain Monte Carlo (fMCMC) are two recently emerged Bayesian inference schemes that perform posterior inference directly in function space by incorporating more informative functional priors. Similar to their parameter-space counterparts, fVI and fMCMC have their own strengths and weaknesses. For instance, fVI is computationally efficient but imposes strong distributional assumptions, while fMCMC is asymptotically exact but suffers from slow mixing in high dimensions. To inherit the complementary benefits of both schemes, this work proposes a novel hybrid inference method for functional posterior inference. Specifically, it combines fVI and fMCMC successively by an elaborate linking mechanism to form an alternating approximation process. We also provide theoretical justification for the soundness of such a hybrid inference through the lens of Wasserstein gradient flows in the function space. We evaluate our method on several benchmark tasks and observe improvements in both predictive accuracy and uncertainty quantification compared to parameter/function-space VI and MCMC.

Applications · Chemistry and Drug Discovery

Gabriel Claude Jean Ducrocq, Lukas Grunewald, Sebastian Westenhoff, Fredrik Lindsten

The three-dimensional structure of proteins plays a crucial role in determining their function. Protein structure prediction methods, like AlphaFold, offer rapid access to a protein’s structure. However, large protein complexes cannot be reliably predicted, and proteins are dynamic, making it important to resolve their full conformational distribution. Single-particle cryo-electron microscopy (cryo-EM) is a powerful tool for determining the structures of large protein complexes. Importantly, the numerous images of a given protein contain underutilized information about conformational heterogeneity. These images are very noisy projections of the protein, and traditional methods for cryo-EM reconstruction are limited to recovering only one or a few consensus conformations.In this paper, we introduce cryoSPHERE, which is a deep learning method that uses a nominal protein structure (e.g., from AlphaFold) as input, learns how to divide it into segments, and moves these segments as approximately rigid bodies to fit the different conformations present in the cryo-EM dataset. This approach provides enough constraints to enable meaningful reconstructions of single protein structural ensembles. We demonstrate this with two synthetic datasets featuring varying levels of noise, as well as two real dataset. We show that cryoSPHERE is very resilient to the high levels of noise typically encountered in experiments, where we see consistent improvements over the current state-of-the-art for heterogeneous reconstruction.