Yifei Shen

Yu Shi, Shuxin Zheng, Guolin Ke et al. · microsoft-research, tsinghua

This technical note describes the recent updates of Graphormer, including architecture design modifications, and the adaption to 3D molecular dynamics simulation. With these simple modifications, Graphormer could attain better results on large-scale molecular modeling datasets than the vanilla one, and the performance gain could be consistently obtained on 2D and 3D molecular graph modeling tasks. In addition, we show that with a global receptive field and an adaptive aggregation strategy, Graphormer is more powerful than classic message-passing-based GNNs. Empirically, Graphormer could achieve much less MAE than the originally reported results on the PCQM4M quantum chemistry dataset used in KDD Cup 2021. In the meanwhile, it greatly outperforms the competitors in the recent Open Catalyst Challenge, which is a competition track on NeurIPS 2021 workshop, and aims to model the catalyst-adsorbate reaction system with advanced AI models. All codes could be found at https://github.com/Microsoft/Graphormer.

Yifei Shen, Jun Zhang, S. H. Song et al.

Deep learning-based approaches have been developed to solve challenging problems in wireless communications, leading to promising results. Early attempts adopted neural network architectures inherited from applications such as computer vision. They often yield poor performance in large scale networks (i.e., poor scalability) and unseen network settings (i.e., poor generalization). To resolve these issues, graph neural networks (GNNs) have been recently adopted, as they can effectively exploit the domain knowledge, i.e., the graph topology in wireless communications problems. GNN-based methods can achieve near-optimal performance in large-scale networks and generalize well under different system settings, but the theoretical underpinnings and design guidelines remain elusive, which may hinder their practical implementations. This paper endeavors to fill both the theoretical and practical gaps. For theoretical guarantees, we prove that GNNs achieve near-optimal performance in wireless networks with much fewer training samples than traditional neural architectures. Specifically, to solve an optimization problem on an $n$-node graph (where the nodes may represent users, base stations, or antennas), GNNs' generalization error and required number of training samples are $\mathcal{O}(n)$ and $\mathcal{O}(n^2)$ times lower than the unstructured multi-layer perceptrons. For design guidelines, we propose a unified framework that is applicable to general design problems in wireless networks, which includes graph modeling, neural architecture design, and theory-guided performance enhancement. Extensive simulations, which cover a variety of important problems and network settings, verify our theory and the effectiveness of the proposed design framework.

Yifei Shen, Jiawei Shao, Xinjie Zhang et al.

The evolution of wireless networks gravitates towards connected intelligence, a concept that envisions seamless interconnectivity among humans, objects, and intelligence in a hyper-connected cyber-physical world. Edge artificial intelligence (Edge AI) is a promising solution to achieve connected intelligence by delivering high-quality, low-latency, and privacy-preserving AI services at the network edge. This article presents a vision of autonomous edge AI systems that automatically organize, adapt, and optimize themselves to meet users' diverse requirements, leveraging the power of large language models (LLMs), i.e., Generative Pretrained Transformer (GPT). By exploiting the powerful abilities of GPT in language understanding, planning, and code generation, as well as incorporating classic wisdom such as task-oriented communication and edge federated learning, we present a versatile framework that efficiently coordinates edge AI models to cater to users' personal demands while automatically generating code to train new models in a privacy-preserving manner. Experimental results demonstrate the system's remarkable ability to accurately comprehend user demands, efficiently execute AI models with minimal cost, and effectively create high-performance AI models at edge servers.

Siwei Li, Yifan Yang, Yifei Shen et al.

Efficient fine-tuning plays a fundamental role in modern large models, with low-rank adaptation emerging as a particularly promising approach. However, the existing variants of LoRA are hampered by limited expressiveness, a tendency to overfit, and sensitivity to hyperparameter settings. This paper presents LoRA Slow Cascade Learning (LoRASC), an innovative technique designed to enhance LoRA's expressiveness and generalization capabilities while preserving its training efficiency. Our approach augments expressiveness through a cascaded learning strategy that enables a mixture-of-low-rank adaptation, thereby increasing the model's ability to capture complex patterns. Additionally, we introduce a slow-fast update mechanism and cascading noisy tuning to bolster generalization. The extensive experiments on various language and vision datasets, as well as robustness benchmarks, demonstrate that the proposed method not only significantly outperforms existing baselines, but also mitigates overfitting, enhances model stability, and improves OOD robustness. Code will be release in https://github.com/microsoft/LoRASC very soon.

Wentao Yu, Yifei Shen, Hengtao He et al.

Terahertz ultra-massive multiple-input multiple-output (THz UM-MIMO) is envisioned as one of the key enablers of 6G wireless systems. Due to the joint effect of its array aperture and small wavelength, the near-field region of THz UM-MIMO is greatly enlarged. The high-dimensional channel of such systems thus consists of a stochastic mixture of far and near fields, which renders channel estimation extremely challenging. Previous works based on uni-field assumptions cannot capture the hybrid far- and near-field features, thus suffering significant performance loss. This motivates us to consider hybrid-field channel estimation. We draw inspirations from fixed point theory to develop an efficient deep learning based channel estimator with adaptive complexity and linear convergence guarantee. Built upon classic orthogonal approximate message passing, we transform each iteration into a contractive mapping, comprising a closed-form linear estimator and a neural network based non-linear estimator. A major algorithmic innovation involves applying fixed point iteration to compute the channel estimate while modeling neural networks with arbitrary depth and adapting to the hybrid-field channel conditions. Simulation results verify our theoretical analysis and show significant performance gains over state-of-the-art approaches in the estimation accuracy and convergence rate.

Yiqi Zhang, Huiqiang Jiang, Xufang Luo et al. · microsoft-research

Scaling reinforcement learning (RL) has shown strong promise for enhancing the reasoning abilities of large language models (LLMs), particularly in tasks requiring long chain-of-thought generation. However, RL training efficiency is often bottlenecked by the rollout phase, which can account for up to 70% of total training time when generating long trajectories (e.g., 16k tokens), due to slow autoregressive generation and synchronization overhead between rollout and policy updates. We propose SortedRL, an online length-aware scheduling strategy designed to address this bottleneck by improving rollout efficiency and maintaining training stability. SortedRL reorders rollout samples based on output lengths, prioritizing short samples forming groups for early updates. This enables large rollout batches, flexible update batches, and near on-policy micro-curriculum construction simultaneously. To further accelerate the pipeline, SortedRL incorporates a mechanism to control the degree of off-policy training through a cache-based mechanism, and is supported by a dedicated RL infrastructure that manages rollout and update via a stateful controller and rollout buffer. Experiments using LLaMA-3.1-8B and Qwen-2.5-32B on diverse tasks, including logical puzzles, and math challenges like AIME 24, Math 500, and Minerval, show that SortedRL reduces RL training bubble ratios by over 50%, while attaining 3.9% to 18.4% superior performance over baseline given same amount of data.

Cairong Zhao, Yubin Wang, Xinyang Jiang et al.

Prompt learning is one of the most effective and trending ways to adapt powerful vision-language foundation models like CLIP to downstream datasets by tuning learnable prompt vectors with very few samples. However, although prompt learning achieves excellent performance over in-domain data, it still faces the major challenge of generalizing to unseen classes and domains. Some existing prompt learning methods tackle this issue by adaptively generating different prompts for different tokens or domains but neglecting the ability of learned prompts to generalize to unseen domains. In this paper, we propose a novel prompt learning paradigm that directly generates \emph{domain invariant} prompt that can be generalized to unseen domains, called MetaPrompt. Specifically, a dual-modality prompt tuning network is proposed to generate prompts for input from both image and text modalities. With a novel asymmetric contrastive loss, the representation from the original pre-trained vision-language model acts as supervision to enhance the generalization ability of the learned prompt. More importantly, we propose a meta-learning-based prompt tuning algorithm that explicitly constrains the task-specific prompt tuned for one domain or class to also achieve good performance in another domain or class. Extensive experiments on 11 datasets for base-to-new generalization and 4 datasets for domain generalization demonstrate that our method consistently and significantly outperforms existing methods.

Yasheng Sun, Yifan Yang, Houwen Peng et al.

While language-guided image manipulation has made remarkable progress, the challenge of how to instruct the manipulation process faithfully reflecting human intentions persists. An accurate and comprehensive description of a manipulation task using natural language is laborious and sometimes even impossible, primarily due to the inherent uncertainty and ambiguity present in linguistic expressions. Is it feasible to accomplish image manipulation without resorting to external cross-modal language information? If this possibility exists, the inherent modality gap would be effortlessly eliminated. In this paper, we propose a novel manipulation methodology, dubbed ImageBrush, that learns visual instructions for more accurate image editing. Our key idea is to employ a pair of transformation images as visual instructions, which not only precisely captures human intention but also facilitates accessibility in real-world scenarios. Capturing visual instructions is particularly challenging because it involves extracting the underlying intentions solely from visual demonstrations and then applying this operation to a new image. To address this challenge, we formulate visual instruction learning as a diffusion-based inpainting problem, where the contextual information is fully exploited through an iterative process of generation. A visual prompting encoder is carefully devised to enhance the model's capacity in uncovering human intent behind the visual instructions. Extensive experiments show that our method generates engaging manipulation results conforming to the transformations entailed in demonstrations. Moreover, our model exhibits robust generalization capabilities on various downstream tasks such as pose transfer, image translation and video inpainting.

Bo Li, Yifei Shen, Jingkang Yang et al.

Human visual perception can easily generalize to out-of-distributed visual data, which is far beyond the capability of modern machine learning models. Domain generalization (DG) aims to close this gap, with existing DG methods mainly focusing on the loss function design. In this paper, we propose to explore an orthogonal direction, i.e., the design of the backbone architecture. It is motivated by an empirical finding that transformer-based models trained with empirical risk minimization (ERM) outperform CNN-based models employing state-of-the-art (SOTA) DG algorithms on multiple DG datasets. We develop a formal framework to characterize a network's robustness to distribution shifts by studying its architecture's alignment with the correlations in the dataset. This analysis guides us to propose a novel DG model built upon vision transformers, namely Generalizable Mixture-of-Experts (GMoE). Extensive experiments on DomainBed demonstrate that GMoE trained with ERM outperforms SOTA DG baselines by a large margin. Moreover, GMoE is complementary to existing DG methods and its performance is substantially improved when trained with DG algorithms.

Ruibin Li, Qihua Zhou, Song Guo et al.

Diffusion-based Generative Models (DGMs) have achieved unparalleled performance in synthesizing high-quality visual content, opening up the opportunity to improve image super-resolution (SR) tasks. Recent solutions for these tasks often train architecture-specific DGMs from scratch, or require iterative fine-tuning and distillation on pre-trained DGMs, both of which take considerable time and hardware investments. More seriously, since the DGMs are established with a discrete pre-defined upsampling scale, they cannot well match the emerging requirements of arbitrary-scale super-resolution (ASSR), where a unified model adapts to arbitrary upsampling scales, instead of preparing a series of distinct models for each case. These limitations beg an intriguing question: can we identify the ASSR capability of existing pre-trained DGMs without the need for distillation or fine-tuning? In this paper, we take a step towards resolving this matter by proposing Diff-SR, a first ASSR attempt based solely on pre-trained DGMs, without additional training efforts. It is motivated by an exciting finding that a simple methodology, which first injects a specific amount of noise into the low-resolution images before invoking a DGM's backward diffusion process, outperforms current leading solutions. The key insight is determining a suitable amount of noise to inject, i.e., small amounts lead to poor low-level fidelity, while over-large amounts degrade the high-level signature. Through a finely-grained theoretical analysis, we propose the Perceptual Recoverable Field (PRF), a metric that achieves the optimal trade-off between these two factors. Extensive experiments verify the effectiveness, flexibility, and adaptability of Diff-SR, demonstrating superior performance to state-of-the-art solutions under diverse ASSR environments.

Yao Cheng, Caihua Shan, Yifei Shen et al.

Label noise is a common challenge in large datasets, as it can significantly degrade the generalization ability of deep neural networks. Most existing studies focus on noisy labels in computer vision; however, graph models encompass both node features and graph topology as input, and become more susceptible to label noise through message-passing mechanisms. Recently, only a few works have been proposed to tackle the label noise on graphs. One significant limitation is that they operate under the assumption that the graph exhibits homophily and that the labels are distributed smoothly. However, real-world graphs can exhibit varying degrees of heterophily, or even be dominated by heterophily, which results in the inadequacy of the current methods. In this paper, we study graph label noise in the context of arbitrary heterophily, with the aim of rectifying noisy labels and assigning labels to previously unlabeled nodes. We begin by conducting two empirical analyses to explore the impact of graph homophily on graph label noise. Following observations, we propose a efficient algorithm, denoted as $R^{2}LP$. Specifically, $R^{2}LP$ is an iterative algorithm with three steps: (1) reconstruct the graph to recover the homophily property, (2) utilize label propagation to rectify the noisy labels, (3) select high-confidence labels to retain for the next iteration. By iterating these steps, we obtain a set of correct labels, ultimately achieving high accuracy in the node classification task. The theoretical analysis is also provided to demonstrate its remarkable denoising effect. Finally, we perform experiments on ten benchmark datasets with different levels of graph heterophily and various types of noise. In these experiments, we compare the performance of $R^{2}LP$ against ten typical baseline methods. Our results illustrate the superior performance of the proposed $R^{2}LP$.

Xiang An, Yin Xie, Feilong Tang et al.

We introduce LLaVA-OneVision-2 (LLaVA-OV-2), the most capable vision-language model in the LLaVA-OneVision series to date, achieving superior performance across a broad range of multimodal benchmarks. The model builds on a native OneVision-Encoder and incorporates Windowed Attention for efficient local computation while maintaining native resolution. Its key advance is codec-stream tokenization: it treats compressed video as a continuous bit-cost stream, where bit-cost dynamics determine adaptive temporal groups, and motion-residual cues select salient spatial evidence into compact visual canvases. This allocation concentrates a limited token budget on event-bearing content, enabling more stable long-video token compression than fixed groups of pictures. A shared 3D RoPE further places codec canvases, sampled frames, and images in a unified spatiotemporal coordinate system. Furthermore, we build the LLaVA-OV-2 data and training stack around large-scale open supervision: approximately 8M re-captioned video samples for pretraining, a 4M-sample spatial corpus for fine-tuning. We also introduce JumpScore, a temporal-localization benchmark targeting fine-grained grounding in high-frequency, densely repeated motion, a regime underrepresented by existing video evaluations. A standout capability of LLaVA-OV-2 is its unified perception across video understanding, temporal grounding, spatial grounding, and manipulation-trace reasoning. On JumpScore, LLaVA-OneVision-2-8B reaches 74.9 JumpScore mAP, surpassing Qwen3-VL-8B (30.1) by +44.8 points; under matched visual-token budgets on the same benchmark, codec-stream inputs improve temporal grounding over frame sampling by +9.7 points. Across standard benchmarks, LLaVA-OneVision-2-8B further outperforms Qwen3-VL-8B by +4.3 average points on video tasks, +5.3 on spatial tasks, and +15.6 average J&F on tracking tasks.

Xinnan Dai, Qihao Wen, Yifei Shen et al.

Large Language Models (LLMs) have achieved great success in various reasoning tasks. In this work, we focus on the graph reasoning ability of LLMs. Although theoretical studies proved that LLMs are capable of handling graph reasoning tasks, empirical evaluations reveal numerous failures. To deepen our understanding on this discrepancy, we revisit the ability of LLMs on three fundamental graph tasks: graph description translation, graph connectivity, and the shortest-path problem. Our findings suggest that LLMs can fail to understand graph structures through text descriptions and exhibit varying performance for all these three fundamental tasks. Meanwhile, we perform a real-world investigation on knowledge graphs and make consistent observations with our findings. The codes and datasets are available.

Feilong Tang, Xiang An, Yunyao Yan et al.

Hypothesis. Artificial general intelligence is, at its core, a compression problem. Effective compression demands resonance: deep learning scales best when its architecture aligns with the fundamental structure of the data. These are the fundamental principles. Yet, modern vision architectures have strayed from these truths: visual signals are highly redundant, while discriminative information, the surprise, is sparse. Current models process dense pixel grids uniformly, wasting vast compute on static background rather than focusing on the predictive residuals that define motion and meaning. We argue that to solve visual understanding, we must align our architectures with the information-theoretic principles of video, i.e., Codecs. Method. OneVision-Encoder encodes video by compressing predictive visual structure into semantic meaning. By adopting Codec Patchification, OV-Encoder abandons uniform computation to focus exclusively on the 3.1%-25% of regions rich in signal entropy. To unify spatial and temporal reasoning under irregular token layouts, OneVision-Encoder employs a shared 3D RoPE and is trained with a large-scale cluster discrimination objective over more than one million semantic concepts, jointly capturing object permanence and motion dynamics. Evidence. The results validate our core hypothesis: efficiency and accuracy are not a trade-off; they are positively correlated. When integrated into LLM, it consistently outperforms strong vision backbones such as Qwen3-ViT and SigLIP2 across 16 image, video, and document understanding benchmarks, despite using substantially fewer visual tokens and pretraining data. Notably, on video understanding tasks, OV-Encoder achieves an average improvement of 4.1% over Qwen3-ViT. Codec-aligned, patch-level sparsity is a foundational principle, enabling OV-Encoder as a scalable engine for next-generation visual generalists.

Zimo Wen, Boxiu Li, Wanbo Zhang et al.

Unified multimodal models have recently demonstrated strong generative capabilities, yet whether and when generation improves understanding remains unclear. Existing benchmarks lack a systematic exploration of the specific tasks where generation facilitates understanding. To this end, we introduce UniG2U-Bench, a comprehensive benchmark categorizing generation-to-understanding (G2U) evaluation into 7 regimes and 30 subtasks, requiring varying degrees of implicit or explicit visual transformations. Extensive evaluation of over 30 models reveals three core findings: 1) Unified models generally underperform their base Vision-Language Models (VLMs), and Generate-then-Answer (GtA) inference typically degrades performance relative to direct inference. 2) Consistent enhancements emerge in spatial intelligence, visual illusions, or multi-round reasoning subtasks, where enhanced spatial and shape perception, as well as multi-step intermediate image states, prove beneficial. 3) Tasks with similar reasoning structures and models sharing architectures exhibit correlated behaviors, suggesting that generation-understanding coupling induces class-consistent inductive biases over tasks, pretraining data, and model architectures. These findings highlight the necessity for more diverse training data and novel paradigms to fully unlock the potential of unified multimodal modeling.

Weiquan Huang, Yifei Shen, Yifan Yang

State space models and Mamba-based models have been increasingly applied across various domains, achieving state-of-the-art performance. This technical report introduces the first attempt to train a transferable Mamba model utilizing contrastive language-image pretraining (CLIP). We have trained Mamba models of varying sizes and undertaken comprehensive evaluations of these models on 26 zero-shot classification datasets and 16 out-of-distribution (OOD) datasets. Our findings reveal that a Mamba model with 67 million parameters is on par with a 307 million-parameter Vision Transformer (ViT) model in zero-shot classification tasks, highlighting the parameter efficiency of Mamba models. In tests of OOD generalization, Mamba-based models exhibit exceptional performance in conditions of OOD image contrast or when subjected to high-pass filtering. However, a Hessian analysis indicates that Mamba models feature a sharper and more non-convex landscape compared to ViT-based models, making them more challenging to train. The source code is available at https://github.com/raytrun/mamba-clip.

Xixi Wu, Yifei Shen, Fangzhou Ge et al.

Node classification is a fundamental task in graph analysis, with broad applications across various fields. Recent breakthroughs in Large Language Models (LLMs) have enabled LLM-based approaches for this task. Although many studies demonstrate the impressive performance of LLM-based methods, the lack of clear design guidelines may hinder their practical application. In this work, we aim to establish such guidelines through a fair and systematic comparison of these algorithms. As a first step, we developed LLMNodeBed, a comprehensive codebase and testbed for node classification using LLMs. It includes 10 homophilic datasets, 4 heterophilic datasets, 8 LLM-based algorithms, 8 classic baselines, and 3 learning paradigms. Subsequently, we conducted extensive experiments, training and evaluating over 2,700 models, to determine the key settings (e.g., learning paradigms and homophily) and components (e.g., model size and prompt) that affect performance. Our findings uncover 8 insights, e.g., (1) LLM-based methods can significantly outperform traditional methods in a semi-supervised setting, while the advantage is marginal in a supervised setting; (2) Graph Foundation Models can beat open-source LLMs but still fall short of strong LLMs like GPT-4o in a zero-shot setting. We hope that the release of LLMNodeBed, along with our insights, will facilitate reproducible research and inspire future studies in this field. Codes and datasets are released at \href{https://llmnodebed.github.io/}{\texttt{https://llmnodebed.github.io/}}.

Chengye Wang, Yifei Shen, Zexi Kuang et al.

We introduce SciVer, the first benchmark specifically designed to evaluate the ability of foundation models to verify claims within a multimodal scientific context. SciVer consists of 3,000 expert-annotated examples over 1,113 scientific papers, covering four subsets, each representing a common reasoning type in multimodal scientific claim verification. To enable fine-grained evaluation, each example includes expert-annotated supporting evidence. We assess the performance of 21 state-of-the-art multimodal foundation models, including o4-mini, Gemini-2.5-Flash, Llama-3.2-Vision, and Qwen2.5-VL. Our experiment reveals a substantial performance gap between these models and human experts on SciVer. Through an in-depth analysis of retrieval-augmented generation (RAG), and human-conducted error evaluations, we identify critical limitations in current open-source models, offering key insights to advance models' comprehension and reasoning in multimodal scientific literature tasks.

Zehui Li, Vallijah Subasri, Yifei Shen et al.

Large Language Models (LLMs) demonstrate remarkable generalizability across diverse tasks, yet genomic foundation models (GFMs) still require separate finetuning for each downstream application, creating significant overhead as model sizes grow. Moreover, existing GFMs are constrained by rigid output formats, limiting their applicability to various genomic tasks. In this work, we revisit the transformer-based auto-regressive models and introduce Omni-DNA, a family of cross-modal multi-task models ranging from 20 million to 1 billion parameters. Our approach consists of two stages: (i) pretraining on DNA sequences with next token prediction objective, and (ii) expanding the multi-modal task-specific tokens and finetuning for multiple downstream tasks simultaneously. When evaluated on the Nucleotide Transformer and GB benchmarks, Omni-DNA achieves state-of-the-art performance on 18 out of 26 tasks. Through multi-task finetuning, Omni-DNA addresses 10 acetylation and methylation tasks at once, surpassing models trained on each task individually. Finally, we design two complex genomic tasks, DNA2Function and Needle-in-DNA, which map DNA sequences to textual functional descriptions and images, respectively, indicating Omni-DNA's cross-modal capabilities to broaden the scope of genomic applications. All the models are available through https://huggingface.co/collections/zehui127

Yifei Shen, Yilun Zhao, Justice Ou et al.

Real-world clinical text-to-SQL requires reasoning over heterogeneous EHR tables, temporal windows, and patient-similarity cohorts to produce executable queries. We introduce CLINSQL, a benchmark of 633 expert-annotated tasks on MIMIC-IV v3.1 that demands multi-table joins, clinically meaningful filters, and executable SQL. Solving CLINSQL entails navigating schema metadata and clinical coding systems, handling long contexts, and composing multi-step queries beyond traditional text-to-SQL. We evaluate 22 proprietary and open-source models under Chain-of-Thought self-refinement and use rubric-based SQL analysis with execution checks that prioritize critical clinical requirements. Despite recent advances, performance remains far from clinical reliability: on the test set, GPT-5-mini attains 74.7% execution score, DeepSeek-R1 leads open-source at 69.2% and Gemini-2.5-Pro drops from 85.5% on Easy to 67.2% on Hard. Progress on CLINSQL marks tangible advances toward clinically reliable text-to-SQL for real-world EHR analytics.

Yu Shi, Shuxin Zheng, Guolin Ke et al.

This technical note describes the recent updates of Graphormer, including architecture design modifications, and the adaption to 3D molecular dynamics simulation. The "Graphormer-V2" could attain better results on large-scale molecular modeling datasets than the vanilla one, and the performance gain could be consistently obtained on downstream tasks. In addition, we show that with a global receptive field and an adaptive aggregation strategy, Graphormer is more powerful than classic message-passing-based GNNs. Graphormer-V2 achieves much less MAE than the vanilla Graphormer on the PCQM4M quantum chemistry dataset used in KDD Cup 2021, where the latter one won the first place in this competition. In the meanwhile, Graphormer-V2 greatly outperforms the competitors in the recent Open Catalyst Challenge, which is a competition track on NeurIPS 2021 workshop, and aims to model the catalyst-adsorbate reaction system with advanced AI models. All models could be found at \url{https://github.com/Microsoft/Graphormer}.

Yifei Shen, Yuanming Shi, Jun Zhang et al.

Deep neural networks have recently emerged as a disruptive technology to solve NP-hard wireless resource allocation problems in a real-time manner. However, the adopted neural network structures, e.g., multi-layer perceptron (MLP) and convolutional neural network (CNN), are inherited from deep learning for image processing tasks, and thus are not tailored to problems in wireless networks. In particular, the performance of these methods deteriorates dramatically when the wireless network size becomes large. In this paper, we propose to utilize graph neural networks (GNNs) to develop scalable methods for solving the power control problem in $K$-user interference channels. Specifically, a $K$-user interference channel is first modeled as a complete graph, where the quantitative information of wireless channels is incorporated as the features of the graph. We then propose an interference graph convolutional neural network (IGCNet) to learn the optimal power control in an unsupervised manner. It is shown that one-layer IGCNet is a universal approximator to continuous set functions, which well matches the permutation invariance property of interference channels and it is robust to imperfect channel state information (CSI). Extensive simulations will show that the proposed IGCNet outperforms existing methods and achieves significant speedup over the classic algorithm for power control, namely, WMMSE. The code is available on https://github.com/yshenaw/Globecom2019.

Haofei Lu, Dongqi Han, Yifei Shen et al.

Diffusion models have recently shown significant potential in solving decision-making problems, particularly in generating behavior plans -- also known as diffusion planning. While numerous studies have demonstrated the impressive performance of diffusion planning, the mechanisms behind the key components of a good diffusion planner remain unclear and the design choices are highly inconsistent in existing studies. In this work, we address this issue through systematic empirical experiments on diffusion planning in an offline reinforcement learning (RL) setting, providing practical insights into the essential components of diffusion planning. We trained and evaluated over 6,000 diffusion models, identifying the critical components such as guided sampling, network architecture, action generation and planning strategy. We revealed that some design choices opposite to the common practice in previous work in diffusion planning actually lead to better performance, e.g., unconditional sampling with selection can be better than guided sampling and Transformer outperforms U-Net as denoising network. Based on these insights, we suggest a simple yet strong diffusion planning baseline that achieves state-of-the-art results on standard offline RL benchmarks.

Siwei Wang, Yifei Shen, Shi Feng et al.

Planning is a crucial element of both human intelligence and contemporary large language models (LLMs). In this paper, we initiate a theoretical investigation into the emergence of planning capabilities in Transformer-based LLMs via their next-word prediction mechanisms. We model planning as a network path-finding task, where the objective is to generate a valid path from a specified source node to a designated target node. Our mathematical characterization shows that Transformer architectures can execute path-finding by embedding the adjacency and reachability matrices within their weights. Furthermore, our theoretical analysis of gradient-based learning dynamics reveals that LLMs can learn both the adjacency and a limited form of the reachability matrices. These theoretical insights are then validated through experiments, which demonstrate that Transformer architectures indeed learn the adjacency and an incomplete reachability matrices, consistent with our theoretical predictions. When applying our methodology to the real-world planning benchmark Blocksworld, our observations remain consistent. Additionally, our analyses uncover a fundamental limitation of current Transformer architectures in path-finding: these architectures cannot identify reachability relationships through transitivity, which leads to failures in generating paths when concatenation is required. These findings provide new insights into how the internal mechanisms of autoregressive learning facilitate intelligent planning and deepen our understanding of how future LLMs might achieve more advanced and general planning-and-reasoning capabilities across diverse applications.

Kaichen Zhang, Yifei Shen, Bo Li et al.

Recent advances in Large Multimodal Models (LMMs) lead to significant breakthroughs in both academia and industry. One question that arises is how we, as humans, can understand their internal neural representations. This paper takes an initial step towards addressing this question by presenting a versatile framework to identify and interpret the semantics within LMMs. Specifically, 1) we first apply a Sparse Autoencoder(SAE) to disentangle the representations into human understandable features. 2) We then present an automatic interpretation framework to interpreted the open-semantic features learned in SAE by the LMMs themselves. We employ this framework to analyze the LLaVA-NeXT-8B model using the LLaVA-OV-72B model, demonstrating that these features can effectively steer the model's behavior. Our results contribute to a deeper understanding of why LMMs excel in specific tasks, including EQ tests, and illuminate the nature of their mistakes along with potential strategies for their rectification. These findings offer new insights into the internal mechanisms of LMMs and suggest parallels with the cognitive processes of the human brain.

Haofei Lu, Yifei Shen, Dongsheng Li et al.

Diffusion models have shown great promise in decision-making, also known as diffusion planning. However, the slow inference speeds limit their potential for broader real-world applications. Here, we introduce Habi, a general framework that transforms powerful but slow diffusion planning models into fast decision-making models, which mimics the cognitive process in the brain that costly goal-directed behavior gradually transitions to efficient habitual behavior with repetitive practice. Even using a laptop CPU, the habitized model can achieve an average 800+ Hz decision-making frequency (faster than previous diffusion planners by orders of magnitude) on standard offline reinforcement learning benchmarks D4RL, while maintaining comparable or even higher performance compared to its corresponding diffusion planner. Our work proposes a fresh perspective of leveraging powerful diffusion models for real-world decision-making tasks. We also provide robust evaluations and analysis, offering insights from both biological and engineering perspectives for efficient and effective decision-making.

Hanchi Sun, Xiaohong Liu, Xinyang Jiang et al.

This paper focuses on the task of quality enhancement for compressed videos. Although deep network-based video restorers achieve impressive progress, most of the existing methods lack a structured design to optimally leverage the priors within compression codecs. Since the quality degradation of the video is primarily induced by the compression algorithm, a new paradigm is urgently needed for a more ``conscious'' process of quality enhancement. As a result, we propose the Compression-Realized Deep Structural Network (CRDS), introducing three inductive biases aligned with the three primary processes in the classic compression codec, merging the strengths of classical encoder architecture with deep network capabilities. Inspired by the residual extraction and domain transformation process in the codec, a pre-trained Latent Degradation Residual Auto-Encoder is proposed to transform video frames into a latent feature space, and the mutual neighborhood attention mechanism is integrated for precise motion estimation and residual extraction. Furthermore, drawing inspiration from the quantization noise distribution of the codec, CRDS proposes a novel Progressive Denoising framework with intermediate supervision that decomposes the quality enhancement into a series of simpler denoising sub-tasks. Experimental results on datasets like LDV 2.0 and MFQE 2.0 indicate our approach surpasses state-of-the-art models.

Kai Wang, Siqiang Luo, Caihua Shan et al.

Inspired by the success of large language models, there is a trend toward developing graph foundation models to conduct diverse downstream tasks in various domains. However, current models often require extra fine-tuning to apply their learned structural and semantic representations to new graphs, which limits their versatility. Recent breakthroughs in zero-shot inductive reasoning on knowledge graphs (KGs), offer us a new perspective on extending KG reasoning to general graph applications. In this paper, we introduce SCR, a unified graph reasoning framework designed to train on knowledge graphs and effectively generalize across a wide range of graph tasks and domains. We begin by designing the task-specific KG structures to establish a unified topology for different task formats. Then we propose semantic-conditioned message passing, a novel mechanism addressing the inherent semantic isolation in traditional KG reasoning, by jointly modeling structural and semantic invariance patterns in graph representations. To demonstrate the effectiveness, we evaluate the inductive reasoning capability of SCR using 38 diverse graph datasets, covering node-level, link-level, and graph-level tasks across multiple domains. Our results show substantial performance gains over existing foundation models and supervised baselines, highlighting the efficacy and adaptability of our approach.

Zixiao Wang, Yifei Shen, Huishuai Zhang

Many optimizers can be interpreted as steepest-descent methods under norm-induced geometries, and thus inherit corresponding implicit biases. We introduce \nameA{} (\fullname{}), which combines spectral control from orthogonalized update directions with $\ell_\infty$-style coordinate control from sign updates. \nameA{} forms a Lion-style momentum direction, approximately orthogonalizes it via a few Newton--Schulz iterations, and then applies an entrywise sign, providing an efficient approximation to taking a maximal step over the intersection of the spectral and $\ell_\infty$ constraint sets (a scaled Hadamard-like set for matrix parameters). Despite the strong nonlinearity of orthogonalization and sign, we prove convergence under a mild, empirically verified diagonal-isotropy assumption. Across large-scale language and vision training, including GPT-2 and Llama pretraining, SiT image pretraining, and supervised fine-tuning, \nameA{} matches or outperforms AdamW and Muon under comparable tuning while using only momentum-level optimizer state, and it mitigates optimizer mismatch when fine-tuning AdamW-pretrained checkpoints.

Kyoungjun Park, Yifan Yang, Juheon Yi et al.

With the rapid advancement of AI-generated videos, there is an urgent need for effective detection tools to mitigate societal risks such as misinformation and reputational harm. In addition to accurate classification, it is essential that detection models provide interpretable explanations to ensure transparency for regulators and end users. To address these challenges, we introduce VidGuard-R1, the first video authenticity detector that fine-tunes a multi-modal large language model (MLLM) using group relative policy optimization (GRPO). Our model delivers both highly accurate judgments and insightful reasoning. We curate a challenging dataset of 140k real and AI-generated videos produced by state-of-the-art generation models, carefully designing the generation process to maximize discrimination difficulty. We then fine-tune Qwen-VL using GRPO with two specialized reward models that target temporal artifacts and generation complexity. Extensive experiments demonstrate that VidGuard-R1 achieves state-of-the-art zero-shot performance on existing benchmarks, with additional training pushing accuracy above 95%. Case studies further show that VidGuard-R1 produces precise and interpretable rationales behind its predictions. The code is publicly available at https://VidGuard-R1.github.io.

Siwei Wang, Yifei Shen, Haoran Sun et al.

Recent reinforcement learning (RL) methods have substantially enhanced the planning capabilities of Large Language Models (LLMs), yet the theoretical basis for their effectiveness remains elusive. In this work, we investigate RL's benefits and limitations through a tractable graph-based abstraction, focusing on policy gradient (PG) and Q-learning methods. Our theoretical analyses reveal that supervised fine-tuning (SFT) may introduce co-occurrence-based spurious solutions, whereas RL achieves correct planning primarily through exploration, underscoring exploration's role in enabling better generalization. However, we also show that PG suffers from diversity collapse, where output diversity decreases during training and persists even after perfect accuracy is attained. By contrast, Q-learning provides two key advantages: off-policy learning and diversity preservation at convergence. We further demonstrate that careful reward design is necessary to prevent reward hacking in Q-learning. Finally, applying our framework to the real-world planning benchmark Blocksworld, we confirm that these behaviors manifest in practice.

Yuhao Xue, Zhifei Zhang, Xinyang Jiang et al.

Adversarial attacks exploiting unrestricted natural perturbations present severe security risks to deep learning systems, yet their transferability across models remains limited due to distribution mismatches between generated adversarial features and real-world data. While recent works utilize pre-trained diffusion models as adversarial priors, they still encounter challenges due to the distribution shift between the distribution of ideal adversarial samples and the natural image distribution learned by the diffusion model. To address the challenge, we propose Transferable Robust Adversarial Images via Latent Diffusion (TRAIL), a test-time adaptation framework that enables the model to generate images from a distribution of images with adversarial features and closely resembles the target images. To mitigate the distribution shift, during attacks, TRAIL updates the diffusion U-Net's weights by combining adversarial objectives (to mislead victim models) and perceptual constraints (to preserve image realism). The adapted model then generates adversarial samples through iterative noise injection and denoising guided by these objectives. Experiments demonstrate that TRAIL significantly outperforms state-of-the-art methods in cross-model attack transferability, validating that distribution-aligned adversarial feature synthesis is critical for practical black-box attacks.

Yifei Shen, Xinyang Jiang, Yezhen Wang et al.

Adding additional control to pretrained diffusion models has become an increasingly popular research area, with extensive applications in computer vision, reinforcement learning, and AI for science. Recently, several studies have proposed training-free loss-based guidance by using off-the-shelf networks pretrained on clean images. This approach enables zero-shot conditional generation for universal control formats, which appears to offer a free lunch in diffusion guidance. In this paper, we aim to develop a deeper understanding of training-free guidance, as well as overcome its limitations. We offer a theoretical analysis that supports training-free guidance from the perspective of optimization, distinguishing it from classifier-based (or classifier-free) guidance. To elucidate their drawbacks, we theoretically demonstrate that training-free guidance is more susceptible to adversarial gradients and exhibits slower convergence rates compared to classifier guidance. We then introduce a collection of techniques designed to overcome the limitations, accompanied by theoretical rationale and empirical evidence. Our experiments in image and motion generation confirm the efficacy of these techniques.

William Wei Wang, Dongqi Han, Xufang Luo et al.

Empowering embodied agents, such as robots, with Artificial Intelligence (AI) has become increasingly important in recent years. A major challenge is task open-endedness. In practice, robots often need to perform tasks with novel goals that are multifaceted, dynamic, lack a definitive "end-state", and were not encountered during training. To tackle this problem, this paper introduces \textit{Diffusion for Open-ended Goals} (DOG), a novel framework designed to enable embodied AI to plan and act flexibly and dynamically for open-ended task goals. DOG synergizes the generative prowess of diffusion models with state-of-the-art, training-free guidance techniques to adaptively perform online planning and control. Our evaluations demonstrate that DOG can handle various kinds of novel task goals not seen during training, in both maze navigation and robot control problems. Our work sheds light on enhancing embodied AI's adaptability and competency in tackling open-ended goals.

Qunxi Zhu, Yifei Shen, Dongsheng Li et al.

Continuous-depth neural networks, such as the Neural Ordinary Differential Equations (ODEs), have aroused a great deal of interest from the communities of machine learning and data science in recent years, which bridge the connection between deep neural networks and dynamical systems. In this article, we introduce a new sort of continuous-depth neural network, called the Neural Piecewise-Constant Delay Differential Equations (PCDDEs). Here, unlike the recently proposed framework of the Neural Delay Differential Equations (DDEs), we transform the single delay into the piecewise-constant delay(s). The Neural PCDDEs with such a transformation, on one hand, inherit the strength of universal approximating capability in Neural DDEs. On the other hand, the Neural PCDDEs, leveraging the contributions of the information from the multiple previous time steps, further promote the modeling capability without augmenting the network dimension. With such a promotion, we show that the Neural PCDDEs do outperform the several existing continuous-depth neural frameworks on the one-dimensional piecewise-constant delay population dynamics and real-world datasets, including MNIST, CIFAR10, and SVHN.

Xinyang Jiang, Lu Liu, Caihua Shan et al.

In this paper, we consider a different data format for images: vector graphics. In contrast to raster graphics which are widely used in image recognition, vector graphics can be scaled up or down into any resolution without aliasing or information loss, due to the analytic representation of the primitives in the document. Furthermore, vector graphics are able to give extra structural information on how low-level elements group together to form high level shapes or structures. These merits of graphic vectors have not been fully leveraged in existing methods. To explore this data format, we target on the fundamental recognition tasks: object localization and classification. We propose an efficient CNN-free pipeline that does not render the graphic into pixels (i.e. rasterization), and takes textual document of the vector graphics as input, called YOLaT (You Only Look at Text). YOLaT builds multi-graphs to model the structural and spatial information in vector graphics, and a dual-stream graph neural network is proposed to detect objects from the graph. Our experiments show that by directly operating on vector graphics, YOLaT out-performs raster-graphic based object detection baselines in terms of both average precision and efficiency.

Yifan Ma, Yifei Shen, Xianghao Yu et al.

The conventional design of wireless communication systems typically relies on established mathematical models that capture the characteristics of different communication modules. Unfortunately, such design cannot be easily and directly applied to future wireless networks, which will be characterized by large-scale ultra-dense networks whose design complexity scales exponentially with the network size. Furthermore, such networks will vary dynamically in a significant way, which makes it intractable to develop comprehensive analytical models. Recently, deep learning-based approaches have emerged as potential alternatives for designing complex and dynamic wireless systems. However, existing learning-based methods have limited capabilities to scale with the problem size and to generalize with varying network settings. In this paper, we propose a scalable and generalizable neural calibration framework for future wireless system design, where a neural network is adopted to calibrate the input of conventional model-based algorithms. Specifically, the backbone of a traditional time-efficient algorithm is integrated with deep neural networks to achieve a high computational efficiency, while enjoying enhanced performance. The permutation equivariance property, carried out by the topological structure of wireless systems, is furthermore utilized to develop a generalizable neural network architecture. The proposed neural calibration framework is applied to solve challenging resource management problems in massive multiple-input multiple-output (MIMO) systems. Simulation results will show that the proposed neural calibration approach enjoys significantly improved scalability and generalization compared with the existing learning-based methods.

Yifei Shen, Yongji Wu, Yao Zhang et al.

Graph convolutional networks (GCNs) have recently enabled a popular class of algorithms for collaborative filtering (CF). Nevertheless, the theoretical underpinnings of their empirical successes remain elusive. In this paper, we endeavor to obtain a better understanding of GCN-based CF methods via the lens of graph signal processing. By identifying the critical role of smoothness, a key concept in graph signal processing, we develop a unified graph convolution-based framework for CF. We prove that many existing CF methods are special cases of this framework, including the neighborhood-based methods, low-rank matrix factorization, linear auto-encoders, and LightGCN, corresponding to different low-pass filters. Based on our framework, we then present a simple and computationally efficient CF baseline, which we shall refer to as Graph Filter based Collaborative Filtering (GF-CF). Given an implicit feedback matrix, GF-CF can be obtained in a closed form instead of expensive training with back-propagation. Experiments will show that GF-CF achieves competitive or better performance against deep learning-based methods on three well-known datasets, notably with a $70\%$ performance gain over LightGCN on the Amazon-book dataset.

Yifan Ma, Yifei Shen, Xianghao Yu et al.

Channel estimation and beamforming play critical roles in frequency-division duplexing (FDD) massive multiple-input multiple-output (MIMO) systems. However, these two modules have been treated as two stand-alone components, which makes it difficult to achieve a global system optimality. In this paper, we propose a deep learning-based approach that directly optimizes the beamformers at the base station according to the received uplink pilots, thereby, bypassing the explicit channel estimation. Different from the existing fully data-driven approach where all the modules are replaced by deep neural networks (DNNs), a neural calibration method is proposed to improve the scalability of the end-to-end design. In particular, the backbone of conventional time-efficient algorithms, i.e., the least-squares (LS) channel estimator and the zero-forcing (ZF) beamformer, is preserved and DNNs are leveraged to calibrate their inputs for better performance. The permutation equivariance property of the formulated resource allocation problem is then identified to design a low-complexity neural network architecture. Simulation results will show the superiority of the proposed neural calibration method over benchmark schemes in terms of both the spectral efficiency and scalability in large-scale wireless networks.

Bo Li, Yifei Shen, Yezhen Wang et al.

Invariant risk minimization (IRM) has recently emerged as a promising alternative for domain generalization. Nevertheless, the loss function is difficult to optimize for nonlinear classifiers and the original optimization objective could fail when pseudo-invariant features and geometric skews exist. Inspired by IRM, in this paper we propose a novel formulation for domain generalization, dubbed invariant information bottleneck (IIB). IIB aims at minimizing invariant risks for nonlinear classifiers and simultaneously mitigating the impact of pseudo-invariant features and geometric skews. Specifically, we first present a novel formulation for invariant causal prediction via mutual information. Then we adopt the variational formulation of the mutual information to develop a tractable loss function for nonlinear classifiers. To overcome the failure modes of IRM, we propose to minimize the mutual information between the inputs and the corresponding representations. IIB significantly outperforms IRM on synthetic datasets, where the pseudo-invariant features and geometric skews occur, showing the effectiveness of proposed formulation in overcoming failure modes of IRM. Furthermore, experiments on DomainBed show that IIB outperforms $13$ baselines by $0.9\%$ on average across $7$ real datasets.

He Wang, Yifei Shen, Ziyuan Wang et al.

In this paper, we investigate the decentralized statistical inference problem, where a network of agents cooperatively recover a (structured) vector from private noisy samples without centralized coordination. Existing optimization-based algorithms suffer from issues of model mismatch and poor convergence speed, and thus their performance would be degraded, provided that the number of communication rounds is limited. This motivates us to propose a learning-based framework, which unrolls well-noted decentralized optimization algorithms (e.g., Prox-DGD and PG-EXTRA) into graph neural networks (GNNs). By minimizing the recovery error via end-to-end training, this learning-based framework resolves the model mismatch issue. Our convergence analysis (with PG-EXTRA as the base algorithm) reveals that the learned model parameters may accelerate the convergence and reduce the recovery error to a large extent. The simulation results demonstrate that the proposed GNN-based learning methods prominently outperform several state-of-the-art optimization-based algorithms in convergence speed and recovery error.

Yifei Shen, Yuanming Shi, Jun Zhang et al.

Deep learning has recently emerged as a disruptive technology to solve challenging radio resource management problems in wireless networks. However, the neural network architectures adopted by existing works suffer from poor scalability, generalization, and lack of interpretability. A long-standing approach to improve scalability and generalization is to incorporate the structures of the target task into the neural network architecture. In this paper, we propose to apply graph neural networks (GNNs) to solve large-scale radio resource management problems, supported by effective neural network architecture design and theoretical analysis. Specifically, we first demonstrate that radio resource management problems can be formulated as graph optimization problems that enjoy a universal permutation equivariance property. We then identify a class of neural networks, named \emph{message passing graph neural networks} (MPGNNs). It is demonstrated that they not only satisfy the permutation equivariance property, but also can generalize to large-scale problems while enjoying a high computational efficiency. For interpretablity and theoretical guarantees, we prove the equivalence between MPGNNs and a class of distributed optimization algorithms, which is then used to analyze the performance and generalization of MPGNN-based methods. Extensive simulations, with power control and beamforming as two examples, will demonstrate that the proposed method, trained in an unsupervised manner with unlabeled samples, matches or even outperforms classic optimization-based algorithms without domain-specific knowledge. Remarkably, the proposed method is highly scalable and can solve the beamforming problem in an interference channel with $1000$ transceiver pairs within $6$ milliseconds on a single GPU.

Yifei Shen, Ye Xue, Jun Zhang et al.

Dictionary learning is a classic representation learning method that has been widely applied in signal processing and data analytics. In this paper, we investigate a family of $\ell_p$-norm ($p>2,p \in \mathbb{N}$) maximization approaches for the complete dictionary learning problem from theoretical and algorithmic aspects. Specifically, we prove that the global maximizers of these formulations are very close to the true dictionary with high probability, even when Gaussian noise is present. Based on the generalized power method (GPM), an efficient algorithm is then developed for the $\ell_p$-based formulations. We further show the efficacy of the developed algorithm: for the population GPM algorithm over the sphere constraint, it first quickly enters the neighborhood of a global maximizer, and then converges linearly in this region. Extensive experiments will demonstrate that the $\ell_p$-based approaches enjoy a higher computational efficiency and better robustness than conventional approaches and $p=3$ performs the best.

Yifei Shen, Yuanming Shi, Jun Zhang et al.

Effective resource management plays a pivotal role in wireless networks, which, unfortunately, results in challenging mixed-integer nonlinear programming (MINLP) problems in most cases. Machine learning-based methods have recently emerged as a disruptive way to obtain near-optimal performance for MINLPs with affordable computational complexity. There have been some attempts in applying such methods to resource management in wireless networks, but these attempts require huge amounts of training samples and lack the capability to handle constrained problems. Furthermore, they suffer from severe performance deterioration when the network parameters change, which commonly happens and is referred to as the task mismatch problem. In this paper, to reduce the sample complexity and address the feasibility issue, we propose a framework of Learning to Optimize for Resource Management (LORM). Instead of the end-to-end learning approach adopted in previous studies, LORM learns the optimal pruning policy in the branch-and-bound algorithm for MINLPs via a sample-efficient method, namely, imitation learning. To further address the task mismatch problem, we develop a transfer learning method via self-imitation in LORM, named LORM-TL, which can quickly adapt a pre-trained machine learning model to the new task with only a few additional unlabeled training samples. Numerical simulations will demonstrate that LORM outperforms specialized state-of-the-art algorithms and achieves near-optimal performance, while achieving significant speedup compared with the branch-and-bound algorithm. Moreover, LORM-TL, by relying on a few unlabeled samples, achieves comparable performance with the model trained from scratch with sufficient labeled samples.