Yaliang Li

Dawei Gao, Haibin Wang, Yaliang Li et al.

Large language models (LLMs) have emerged as a new paradigm for Text-to-SQL task. However, the absence of a systematical benchmark inhibits the development of designing effective, efficient and economic LLM-based Text-to-SQL solutions. To address this challenge, in this paper, we first conduct a systematical and extensive comparison over existing prompt engineering methods, including question representation, example selection and example organization, and with these experimental results, we elaborate their pros and cons. Based on these findings, we propose a new integrated solution, named DAIL-SQL, which refreshes the Spider leaderboard with 86.6% execution accuracy and sets a new bar. To explore the potential of open-source LLM, we investigate them in various scenarios, and further enhance their performance with supervised fine-tuning. Our explorations highlight open-source LLMs' potential in Text-to-SQL, as well as the advantages and disadvantages of the supervised fine-tuning. Additionally, towards an efficient and economic LLM-based Text-to-SQL solution, we emphasize the token efficiency in prompt engineering and compare the prior studies under this metric. We hope that our work provides a deeper understanding of Text-to-SQL with LLMs, and inspires further investigations and broad applications.

Yupeng Hou, Shanlei Mu, Wayne Xin Zhao et al.

In order to develop effective sequential recommenders, a series of sequence representation learning (SRL) methods are proposed to model historical user behaviors. Most existing SRL methods rely on explicit item IDs for developing the sequence models to better capture user preference. Though effective to some extent, these methods are difficult to be transferred to new recommendation scenarios, due to the limitation by explicitly modeling item IDs. To tackle this issue, we present a novel universal sequence representation learning approach, named UniSRec. The proposed approach utilizes the associated description text of items to learn transferable representations across different recommendation scenarios. For learning universal item representations, we design a lightweight item encoding architecture based on parametric whitening and mixture-of-experts enhanced adaptor. For learning universal sequence representations, we introduce two contrastive pre-training tasks by sampling multi-domain negatives. With the pre-trained universal sequence representation model, our approach can be effectively transferred to new recommendation domains or platforms in a parameter-efficient way, under either inductive or transductive settings. Extensive experiments conducted on real-world datasets demonstrate the effectiveness of the proposed approach. Especially, our approach also leads to a performance improvement in a cross-platform setting, showing the strong transferability of the proposed universal SRL method. The code and pre-trained model are available at: https://github.com/RUCAIBox/UniSRec.

Zhen Wang, Weirui Kuang, Ce Zhang et al. · eth-zurich

Hyperparameter optimization (HPO) is crucial for machine learning algorithms to achieve satisfactory performance, whose progress has been boosted by related benchmarks. Nonetheless, existing efforts in benchmarking all focus on HPO for traditional centralized learning while ignoring federated learning (FL), a promising paradigm for collaboratively learning models from dispersed data. In this paper, we first identify some uniqueness of HPO for FL algorithms from various aspects. Due to this uniqueness, existing HPO benchmarks no longer satisfy the need to compare HPO methods in the FL setting. To facilitate the research of HPO in the FL setting, we propose and implement a benchmark suite FedHPO-B that incorporates comprehensive FL tasks, enables efficient function evaluations, and eases continuing extensions. We also conduct extensive experiments based on FedHPO-B to benchmark a few HPO methods. We open-source FedHPO-B at https://github.com/alibaba/FederatedScope/tree/master/benchmark/FedHPOB.

Yuexiang Xie, Zhen Wang, Dawei Gao et al.

Although remarkable progress has been made by existing federated learning (FL) platforms to provide infrastructures for development, these platforms may not well tackle the challenges brought by various types of heterogeneity, including the heterogeneity in participants' local data, resources, behaviors and learning goals. To fill this gap, in this paper, we propose a novel FL platform, named FederatedScope, which employs an event-driven architecture to provide users with great flexibility to independently describe the behaviors of different participants. Such a design makes it easy for users to describe participants with various local training processes, learning goals and backends, and coordinate them into an FL course with synchronous or asynchronous training strategies. Towards an easy-to-use and flexible platform, FederatedScope enables rich types of plug-in operations and components for efficient further development, and we have implemented several important components to better help users with privacy protection, attack simulation and auto-tuning. We have released FederatedScope at https://github.com/alibaba/FederatedScope to promote academic research and industrial deployment of federated learning in a wide range of scenarios.

Zhen Wang, Weirui Kuang, Yuexiang Xie et al.

The incredible development of federated learning (FL) has benefited various tasks in the domains of computer vision and natural language processing, and the existing frameworks such as TFF and FATE has made the deployment easy in real-world applications. However, federated graph learning (FGL), even though graph data are prevalent, has not been well supported due to its unique characteristics and requirements. The lack of FGL-related framework increases the efforts for accomplishing reproducible research and deploying in real-world applications. Motivated by such strong demand, in this paper, we first discuss the challenges in creating an easy-to-use FGL package and accordingly present our implemented package FederatedScope-GNN (FS-G), which provides (1) a unified view for modularizing and expressing FGL algorithms; (2) comprehensive DataZoo and ModelZoo for out-of-the-box FGL capability; (3) an efficient model auto-tuning component; and (4) off-the-shelf privacy attack and defense abilities. We validate the effectiveness of FS-G by conducting extensive experiments, which simultaneously gains many valuable insights about FGL for the community. Moreover, we employ FS-G to serve the FGL application in real-world E-commerce scenarios, where the attained improvements indicate great potential business benefits. We publicly release FS-G, as submodules of FederatedScope, at https://github.com/alibaba/FederatedScope to promote FGL's research and enable broad applications that would otherwise be infeasible due to the lack of a dedicated package.

Daoyuan Chen, Dawei Gao, Weirui Kuang et al.

Personalized Federated Learning (pFL), which utilizes and deploys distinct local models, has gained increasing attention in recent years due to its success in handling the statistical heterogeneity of FL clients. However, standardized evaluation and systematical analysis of diverse pFL methods remain a challenge. Firstly, the highly varied datasets, FL simulation settings and pFL implementations prevent easy and fair comparisons of pFL methods. Secondly, the current pFL literature diverges in the adopted evaluation and ablation protocols. Finally, the effectiveness and robustness of pFL methods are under-explored in various practical scenarios, such as the generalization to new clients and the participation of resource-limited clients. To tackle these challenges, we propose the first comprehensive pFL benchmark, pFL-Bench, for facilitating rapid, reproducible, standardized and thorough pFL evaluation. The proposed benchmark contains more than 10 dataset variants in various application domains with a unified data partition and realistic heterogeneous settings; a modularized and easy-to-extend pFL codebase with more than 20 competitive pFL method implementations; and systematic evaluations under containerized environments in terms of generalization, fairness, system overhead, and convergence. We highlight the benefits and potential of state-of-the-art pFL methods and hope the pFL-Bench enables further pFL research and broad applications that would otherwise be difficult owing to the absence of a dedicated benchmark. The code is released at https://github.com/alibaba/FederatedScope/tree/master/benchmark/pFL-Bench.

Daoyuan Chen, Yilun Huang, Zhijian Ma et al.

The immense evolution in Large Language Models (LLMs) has underscored the importance of massive, heterogeneous, and high-quality data. A data recipe is a mixture of data from different sources for training LLMs, which plays a vital role in LLMs' performance. Existing open-source tools for LLM data processing are mostly tailored for specific data recipes. To continuously uncover the potential of LLMs, incorporate data from new sources, and improve LLMs' performance, we build a new system named Data-Juicer, with which we can efficiently generate diverse data recipes, explore different possibilities in forming data mixtures, and evaluate their effects on model performance. Different from traditional data-analytics pipelines, Data-Juicer faces some unique challenges. Firstly, the possible data sources for forming data recipes are truly heterogeneous and massive with various qualities. Secondly, it is extremely expensive to precisely evaluate data recipes' impact on LLMs' performance. Thirdly, the end users of Data-Juicer, model developers, need sufficient flexibility to configure and evaluate different data recipes. Data-Juicer features a fine-grained abstraction of pipelines for constructing data recipes, with over 50 built-in operators for easy composition and extension. By incorporating visualization and auto-evaluation capabilities, Data-Juicer enables a timely feedback loop for both LLM pre-training and fine-tuning. Further, Data-Juicer is optimized and integrated with ecosystems for LLM training, evaluation, and distributed computing. The data recipes derived with Data-Juicer gain notable improvements on state-of-the-art LLMs, by up to 7.45% increase in averaged score across 16 LLM benchmarks and 17.5% higher win rate in pair-wise GPT-4 evaluations. Our system, data recipes, and tutorials are released, calling for broader data-centric research on training and understanding LLMs.

Lu Yi, Runlin Lei, Liuyi Yao et al.

LLM agents increasingly face long-horizon tasks such as web search and deep research in real-world applications, where accumulated context can cause long-context degradation and reasoning failures. Prior work mitigates this through context management with agent-side context control or fixed strategies such as summarization, which require training the agent itself for adaptation - making it impractical for closed-source agents and ignoring that different agents may require different strategies. We introduce Adaptive Context Management (AdaCoM), which trains an external LLM to manage the context of a frozen agent through flexible modification actions and end-to-end reinforcement learning. Across diverse agents on web search and deep research benchmarks, AdaCoM substantially improves performance by preserving task constraints and progress while pruning stale content. The learned strategies reveal a Fidelity-Reliability Trade-off: agents with higher vanilla ReAct performance benefit from higher-fidelity context preservation, whereas lower-performing agents require more aggressive compression to stay within a reliable reasoning regime. Transfer experiments show that AdaCoM generalizes most effectively across agents with similar capability (measured by vanilla ReAct performance), suggesting a practical path toward reusable context managers for agent systems.

Zeyu Qin, Liuyi Yao, Daoyuan Chen et al.

In this work, besides improving prediction accuracy, we study whether personalization could bring robustness benefits to backdoor attacks. We conduct the first study of backdoor attacks in the pFL framework, testing 4 widely used backdoor attacks against 6 pFL methods on benchmark datasets FEMNIST and CIFAR-10, a total of 600 experiments. The study shows that pFL methods with partial model-sharing can significantly boost robustness against backdoor attacks. In contrast, pFL methods with full model-sharing do not show robustness. To analyze the reasons for varying robustness performances, we provide comprehensive ablation studies on different pFL methods. Based on our findings, we further propose a lightweight defense method, Simple-Tuning, which empirically improves defense performance against backdoor attacks. We believe that our work could provide both guidance for pFL application in terms of its robustness and offer valuable insights to design more robust FL methods in the future. We open-source our code to establish the first benchmark for black-box backdoor attacks in pFL: https://github.com/alibaba/FederatedScope/tree/backdoor-bench.

Liuyi Yao, Dawei Gao, Zhen Wang et al.

To investigate the heterogeneity in federated learning in real-world scenarios, we generalize the classic federated learning to federated hetero-task learning, which emphasizes the inconsistency across the participants in federated learning in terms of both data distribution and learning tasks. We also present B-FHTL, a federated hetero-task learning benchmark consisting of simulation dataset, FL protocols and a unified evaluation mechanism. B-FHTL dataset contains three well-designed federated learning tasks with increasing heterogeneity. Each task simulates the clients with different non-IID data and learning tasks. To ensure fair comparison among different FL algorithms, B-FHTL builds in a full suite of FL protocols by providing high-level APIs to avoid privacy leakage, and presets most common evaluation metrics spanning across different learning tasks, such as regression, classification, text generation and etc. Furthermore, we compare the FL algorithms in fields of federated multi-task learning, federated personalization and federated meta learning within B-FHTL, and highlight the influence of heterogeneity and difficulties of federated hetero-task learning. Our benchmark, including the federated dataset, protocols, the evaluation mechanism and the preliminary experiment, is open-sourced at https://github.com/alibaba/FederatedScope/tree/master/benchmark/B-FHTL

Chenhe Dong, Yuexiang Xie, Bolin Ding et al.

The increasing privacy concerns on personal private text data promote the development of federated learning (FL) in recent years. However, the existing studies on applying FL in NLP are not suitable to coordinate participants with heterogeneous or private learning objectives. In this study, we further broaden the application scope of FL in NLP by proposing an Assign-Then-Contrast (denoted as ATC) framework, which enables clients with heterogeneous NLP tasks to construct an FL course and learn useful knowledge from each other. Specifically, the clients are suggested to first perform local training with the unified tasks assigned by the server rather than using their own learning objectives, which is called the Assign training stage. After that, in the Contrast training stage, clients train with different local learning objectives and exchange knowledge with other clients who contribute consistent and useful model updates. We conduct extensive experiments on six widely-used datasets covering both Natural Language Understanding (NLU) and Natural Language Generation (NLG) tasks, and the proposed ATC framework achieves significant improvements compared with various baseline methods. The source code is available at \url{https://github.com/alibaba/FederatedScope/tree/master/federatedscope/nlp/hetero_tasks}.

Yupeng Hou, Wayne Xin Zhao, Yaliang Li et al.

To develop effective and efficient graph similarity learning (GSL) models, a series of data-driven neural algorithms have been proposed in recent years. Although GSL models are frequently deployed in privacy-sensitive scenarios, the user privacy protection of neural GSL models has not drawn much attention. To comprehensively understand the privacy protection issues, we first introduce the concept of attackable representation to systematically characterize the privacy attacks that each model can face. Inspired by the qualitative results, we propose a novel Privacy-Preserving neural Graph Matching network model, named PPGM, for graph similarity learning. To prevent reconstruction attacks, the proposed model does not communicate node-level representations between devices. Instead, we learn multi-perspective graph representations based on learnable context vectors. To alleviate the attacks to graph properties, the obfuscated features that contain information from both graphs are communicated. In this way, the private properties of each graph can be difficult to infer. Based on the node-graph matching techniques while calculating the obfuscated features, PPGM can also be effective in similarity measuring. To quantitatively evaluate the privacy-preserving ability of neural GSL models, we further propose an evaluation protocol via training supervised black-box attack models. Extensive experiments on widely-used benchmarks show the effectiveness and strong privacy-protection ability of the proposed model PPGM. The code is available at: https://github.com/RUCAIBox/PPGM.

Zhen Qin, Daoyuan Chen, Wenhao Zhang et al.

The rapid development of large language models (LLMs) has been witnessed in recent years. Based on the powerful LLMs, multi-modal LLMs (MLLMs) extend the modality from text to a broader spectrum of domains, attracting widespread attention due to the broader range of application scenarios. As LLMs and MLLMs rely on vast amounts of model parameters and data to achieve emergent capabilities, the importance of data is receiving increasingly widespread attention and recognition. Tracing and analyzing recent data-oriented works for MLLMs, we find that the development of models and data is not two separate paths but rather interconnected. On the one hand, vaster and higher-quality data contribute to better performance of MLLMs; on the other hand, MLLMs can facilitate the development of data. The co-development of multi-modal data and MLLMs requires a clear view of 1) at which development stages of MLLMs specific data-centric approaches can be employed to enhance certain MLLM capabilities, and 2) how MLLMs, utilizing those capabilities, can contribute to multi-modal data in specific roles. To promote the data-model co-development for MLLM community, we systematically review existing works related to MLLMs from the data-model co-development perspective. A regularly maintained project associated with this survey is accessible at https://github.com/modelscope/data-juicer/blob/main/docs/awesome_llm_data.md.

Chenxi Sun, Hongyan Li, Yaliang Li et al.

This work summarizes two ways to accomplish Time-Series (TS) tasks in today's Large Language Model (LLM) context: LLM-for-TS (model-centric) designs and trains a fundamental large model, or fine-tunes a pre-trained LLM for TS data; TS-for-LLM (data-centric) converts TS into a model-friendly representation to enable the pre-trained LLM to handle TS data. Given the lack of data, limited resources, semantic context requirements, and so on, this work focuses on TS-for-LLM, where we aim to activate LLM's ability for TS data by designing a TS embedding method suitable for LLM. The proposed method is named TEST. It first tokenizes TS, builds an encoder to embed TS via instance-wise, feature-wise, and text-prototype-aligned contrast, where the TS embedding space is aligned to LLM embedding layer space, then creates soft prompts to make LLM more open to that embeddings, and finally implements TS tasks using the frozen LLM. We also demonstrate the feasibility of TS-for-LLM through theory and experiments. Experiments are carried out on TS classification, forecasting, and representation tasks using eight frozen LLMs with various structures and sizes. The results show that the pre-trained LLM with TEST strategy can achieve better or comparable performance than today's SOTA TS models and offer benefits for few-shot and generalization. By treating LLM as the pattern machine, TEST can endow LLM's ability to process TS data without compromising language ability. We hope that this study will serve as a foundation for future work to support TS+LLM progress.

Xuchen Pan, Dawei Gao, Yuexiang Xie et al.

Recent advances in large language models (LLMs) have opened new avenues for applying multi-agent systems in very large-scale simulations. However, there remain several challenges when conducting multi-agent simulations with existing platforms, such as limited scalability and low efficiency, unsatisfied agent diversity, and effort-intensive management processes. To address these challenges, we develop several new features and components for AgentScope, a user-friendly multi-agent platform, enhancing its convenience and flexibility for supporting very large-scale multi-agent simulations. Specifically, we propose an actor-based distributed mechanism as the underlying technological infrastructure towards great scalability and high efficiency, and provide flexible environment support for simulating various real-world scenarios, which enables parallel execution of multiple agents, automatic workflow conversion for distributed deployment, and both inter-agent and agent-environment interactions. Moreover, we integrate an easy-to-use configurable tool and an automatic background generation pipeline in AgentScope, simplifying the process of creating agents with diverse yet detailed background settings. Last but not least, we provide a web-based interface for conveniently monitoring and managing a large number of agents that might deploy across multiple devices. We conduct a comprehensive simulation to demonstrate the effectiveness of these proposed enhancements in AgentScope, and provide detailed observations and insightful discussions to highlight the great potential of applying multi-agent systems in large-scale simulations. The source code is released on GitHub at https://github.com/modelscope/agentscope/tree/main/examples/paper_large_scale_simulation to inspire further research and development in large-scale multi-agent simulations.

Peiyu Liu, Zikang Liu, Ze-Feng Gao et al.

Despite the superior performance, Large Language Models~(LLMs) require significant computational resources for deployment and use. To overcome this issue, quantization methods have been widely applied to reduce the memory footprint of LLMs as well as increasing the inference rate. However, a major challenge is that low-bit quantization methods often lead to performance degradation. It is important to understand how quantization impacts the capacity of LLMs. Different from previous studies focused on overall performance, this work aims to investigate the impact of quantization on \emph{emergent abilities}, which are important characteristics that distinguish LLMs from small language models. Specially, we examine the abilities of in-context learning, chain-of-thought reasoning, and instruction-following in quantized LLMs. Our empirical experiments show that these emergent abilities still exist in 4-bit quantization models, while 2-bit models encounter severe performance degradation on the test of these abilities. To improve the performance of low-bit models, we conduct two special experiments: (1) fine-gained impact analysis that studies which components (or substructures) are more sensitive to quantization, and (2) performance compensation through model fine-tuning. Our work derives a series of important findings to understand the impact of quantization on emergent abilities, and sheds lights on the possibilities of extremely low-bit quantization for LLMs.

Chenhe Dong, Yuexiang Xie, Bolin Ding et al.

Federated learning (FL) enables multiple participants to collaboratively train machine learning models using decentralized data sources, alleviating privacy concerns that arise from directly sharing local data. However, the lack of model privacy protection in FL becomes an unneglectable challenge, especially when people want to federally finetune models based on a proprietary large language model. In this study, we propose a novel FL training approach that accomplishes information exchange among participants via tunable soft prompts. These soft prompts, updated and transmitted between the server and clients, assume the role of the global model parameters and serve as messengers to deliver useful knowledge from the local data and global model. As the global model itself is not required to be shared and the local training is conducted based on an auxiliary model with fewer parameters than the global model, the proposed approach provides protection for the global model while reducing communication and computation costs in FL. Extensive experiments show the effectiveness of the proposed approach compared to several baselines. We have released the source code at \url{https://github.com/alibaba/FederatedScope/tree/fedsp/federatedscope/nlp/fedsp}.

Daoyuan Chen, Haibin Wang, Yilun Huang et al.

The emergence of multimodal large models has advanced artificial intelligence, introducing unprecedented levels of performance and functionality. However, optimizing these models remains challenging due to historically isolated paths of model-centric and data-centric developments, leading to suboptimal outcomes and inefficient resource utilization. In response, we present a new sandbox suite tailored for integrated data-model co-development. This sandbox provides a feedback-driven experimental platform, enabling cost-effective iteration and guided refinement of both data and models. Our proposed ``Probe-Analyze-Refine'' workflow, validated through practical use cases on multimodal tasks such as image-text pre-training with CLIP, image-to-text generation with LLaVA-like models, and text-to-video generation with DiT-based models, yields transferable and notable performance boosts, such as topping the VBench leaderboard. A comprehensive set of over 100 experiments demonstrated the suite's usability and extensibility, while also uncovering insights into the interplay between data quality, diversity, model behavior, and computational costs. All codes, datasets, and models are open-sourced to foster future research and applications that would otherwise be infeasible due to the lack of a dedicated co-development infrastructure.

Runlin Lei, Zhen Wang, Yaliang Li et al.

Graph Neural Networks (GNNs) have received extensive research attention for their promising performance in graph machine learning. Despite their extraordinary predictive accuracy, existing approaches, such as GCN and GPRGNN, are not robust in the face of homophily changes on test graphs, rendering these models vulnerable to graph structural attacks and with limited capacity in generalizing to graphs of varied homophily levels. Although many methods have been proposed to improve the robustness of GNN models, most of these techniques are restricted to the spatial domain and employ complicated defense mechanisms, such as learning new graph structures or calculating edge attentions. In this paper, we study the problem of designing simple and robust GNN models in the spectral domain. We propose EvenNet, a spectral GNN corresponding to an even-polynomial graph filter. Based on our theoretical analysis in both spatial and spectral domains, we demonstrate that EvenNet outperforms full-order models in generalizing across homophilic and heterophilic graphs, implying that ignoring odd-hop neighbors improves the robustness of GNNs. We conduct experiments on both synthetic and real-world datasets to demonstrate the effectiveness of EvenNet. Notably, EvenNet outperforms existing defense models against structural attacks without introducing additional computational costs and maintains competitiveness in traditional node classification tasks on homophilic and heterophilic graphs.

Daoyuan Chen, Dawei Gao, Yuexiang Xie et al.

Federated Learning (FL) aims to train high-quality models in collaboration with distributed clients while not uploading their local data, which attracts increasing attention in both academia and industry. However, there is still a considerable gap between the flourishing FL research and real-world scenarios, mainly caused by the characteristics of heterogeneous devices and its scales. Most existing works conduct evaluations with homogeneous devices, which are mismatched with the diversity and variability of heterogeneous devices in real-world scenarios. Moreover, it is challenging to conduct research and development at scale with heterogeneous devices due to limited resources and complex software stacks. These two key factors are important yet underexplored in FL research as they directly impact the FL training dynamics and final performance, making the effectiveness and usability of FL algorithms unclear. To bridge the gap, in this paper, we propose an efficient and scalable prototyping system for real-world cross-device FL, FS-Real. It supports heterogeneous device runtime, contains parallelism and robustness enhanced FL server, and provides implementations and extensibility for advanced FL utility features such as personalization, communication compression and asynchronous aggregation. To demonstrate the usability and efficiency of FS-Real, we conduct extensive experiments with various device distributions, quantify and analyze the effect of the heterogeneous device and various scales, and further provide insights and open discussions about real-world FL scenarios. Our system is released to help to pave the way for further real-world FL research and broad applications involving diverse devices and scales.

Fangyuan Zhao, Yuexiang Xie, Xuebin Ren et al.

Federated learning (FL) becomes vulnerable to Byzantine attacks where some of participators tend to damage the utility or discourage the convergence of the learned model via sending their malicious model updates. Previous works propose to apply robust rules to aggregate updates from participators against different types of Byzantine attacks, while at the same time, attackers can further design advanced Byzantine attack algorithms targeting specific aggregation rule when it is known. In practice, FL systems can involve a black-box server that makes the adopted aggregation rule inaccessible to participants, which can naturally defend or weaken some Byzantine attacks. In this paper, we provide an in-depth understanding on the Byzantine robustness of the FL system with a black-box server. Our investigation demonstrates the improved Byzantine robustness of a black-box server employing a dynamic defense strategy. We provide both empirical evidence and theoretical analysis to reveal that the black-box server can mitigate the worst-case attack impact from a maximum level to an expectation level, which is attributed to the inherent inaccessibility and randomness offered by a black-box server.The source code is available at https://github.com/alibaba/FederatedScope/tree/Byzantine_attack_defense to promote further research in the community.

Qian Tao, Zhen Wang, Wenyuan Yu et al.

In recent years, a plethora of spectral graph neural networks (GNN) methods have utilized polynomial basis with learnable coefficients to achieve top-tier performances on many node-level tasks. Although various kinds of polynomial bases have been explored, each such method adopts a fixed polynomial basis which might not be the optimal choice for the given graph. Besides, we identify the so-called over-passing issue of these methods and show that it is somewhat rooted in their less-principled regularization strategy and unnormalized basis. In this paper, we make the first attempts to address these two issues. Leveraging Jacobi polynomials, we design a novel spectral GNN, LON-GNN, with Learnable OrthoNormal bases and prove that regularizing coefficients becomes equivalent to regularizing the norm of learned filter function now. We conduct extensive experiments on diverse graph datasets to evaluate the fitting and generalization capability of LON-GNN, where the results imply its superiority.

Mingyuan Fan, Xiaodan Li, Cen Chen et al.

A prevailing belief in attack and defense community is that the higher flatness of adversarial examples enables their better cross-model transferability, leading to a growing interest in employing sharpness-aware minimization and its variants. However, the theoretical relationship between the transferability of adversarial examples and their flatness has not been well established, making the belief questionable. To bridge this gap, we embark on a theoretical investigation and, for the first time, derive a theoretical bound for the transferability of adversarial examples with few practical assumptions. Our analysis challenges this belief by demonstrating that the increased flatness of adversarial examples does not necessarily guarantee improved transferability. Moreover, building upon the theoretical analysis, we propose TPA, a Theoretically Provable Attack that optimizes a surrogate of the derived bound to craft adversarial examples. Extensive experiments across widely used benchmark datasets and various real-world applications show that TPA can craft more transferable adversarial examples compared to state-of-the-art baselines. We hope that these results can recalibrate preconceived impressions within the community and facilitate the development of stronger adversarial attack and defense mechanisms. The source codes are available in <https://github.com/fmy266/TPA>.

Shen Li, Liuyi Yao, Lan Zhang et al.

Aligned LLMs are secure, capable of recognizing and refusing to answer malicious questions. However, the role of internal parameters in maintaining such security is not well understood yet, further these models can be vulnerable to security degradation when subjected to fine-tuning attacks. To address these challenges, our work uncovers the mechanism behind security in aligned LLMs at the parameter level, identifying a small set of contiguous layers in the middle of the model that are crucial for distinguishing malicious queries from normal ones, referred to as ``safety layers". We first confirm the existence of these safety layers by analyzing variations in input vectors within the model's internal layers. Additionally, we leverage the over-rejection phenomenon and parameters scaling analysis to precisely locate the safety layers. Building on these findings, we propose a novel fine-tuning approach, Safely Partial-Parameter Fine-Tuning (SPPFT), that fixes the gradient of the safety layers during fine-tuning to address the security degradation. Our experiments demonstrate that the proposed approach can significantly preserve LLM security while maintaining performance and reducing computational resources compared to full fine-tuning.

Zhiwen Li, Zhongjie Duan, Jinyan Ye et al.

Replicating In-Context Learning (ICL) in computer vision remains challenging due to task heterogeneity. We propose \textbf{VIRAL}, a framework that elicits visual reasoning from a pre-trained image editing model by formulating ICL as conditional generation via visual analogy ($x_s : x_t :: x_q : y_q$). We adapt a frozen Diffusion Transformer (DiT) using role-aware multi-image conditioning and introduce a Mixture-of-Experts LoRA to mitigate gradient interference across diverse tasks. Additionally, to bridge the gaps in current visual context datasets, we curate a large-scale dataset spanning perception, restoration, and editing. Experiments demonstrate that VIRAL outperforms existing methods, validating that a unified V-ICL paradigm can handle the majority of visual tasks, including open-domain editing. Our code is available at https://anonymous.4open.science/r/VIRAL-744A

Delong Zeng, Yuexiang Xie, Yaliang Li et al.

Multimodal retrieval has emerged as a promising yet challenging research direction in recent years. Most existing studies in multimodal retrieval focus on capturing information in multimodal data that is similar to their paired texts, but often ignores the complementary information contained in multimodal data. In this study, we propose CIEA, a novel multimodal retrieval approach that employs Complementary Information Extraction and Alignment, which transforms both text and images in documents into a unified latent space and features a complementary information extractor designed to identify and preserve differences in the image representations. We optimize CIEA using two complementary contrastive losses to ensure semantic integrity and effectively capture the complementary information contained in images. Extensive experiments demonstrate the effectiveness of CIEA, which achieves significant improvements over both divide-and-conquer models and universal dense retrieval models. We provide an ablation study, further discussions, and case studies to highlight the advancements achieved by CIEA. To promote further research in the community, we have released the source code at https://github.com/zengdlong/CIEA.

Yuping Lin, Zitao Li, Yue Xing et al.

Recent studies have identified "retrieval heads" in Large Language Models (LLMs) responsible for extracting information from input contexts. However, prior works largely rely on static statistics aggregated across datasets, identifying heads that perform retrieval on average. This perspective overlooks the fine-grained temporal dynamics of autoregressive generation. In this paper, we investigate retrieval heads from a dynamic perspective. Through extensive analysis, we establish three core claims: (1) Dynamism: Retrieval heads vary dynamically across timesteps; (2) Irreplaceability: Dynamic retrieval heads are specific at each timestep and cannot be effectively replaced by static retrieval heads; and (3) Correlation: The model's hidden state encodes a predictive signal for future retrieval head patterns, indicating an internal planning mechanism. We validate these findings on the Needle-in-a-Haystack task and a multi-hop QA task, and quantify the differences on the utility of dynamic and static retrieval heads in a Dynamic Retrieval-Augmented Generation framework. Our study provides new insights into the internal mechanisms of LLMs.

Weijie Shi, Yanxi Chen, Zexi Li et al.

Reinforcement learning drives recent advances in LLM reasoning and agentic capabilities, yet current approaches struggle with both exploration and exploitation. Exploration suffers from low success rates on difficult tasks and high costs of repeated rollouts from scratch. Exploitation suffers from coarse credit assignment and training instability: Trajectory-level rewards penalize valid prefixes for later errors, and failure-dominated groups overwhelm the few positive signals, leaving optimization without constructive direction. To this end, we propose R$^3$L, Reflect-then-Retry Reinforcement Learning with Language-Guided Exploration, Pivotal Credit, and Positive Amplification. To synthesize high-quality trajectories, R$^3$L shifts from stochastic sampling to active synthesis via reflect-then-retry, leveraging language feedback to diagnose errors, transform failed attempts into successful ones, and reduce rollout costs by restarting from identified failure points. With errors diagnosed and localized, Pivotal Credit Assignment updates only the diverging suffix where contrastive signals exist, excluding the shared prefix from gradient update. Since failures dominate on difficult tasks and reflect-then-retry produces off-policy data, risking training instability, Positive Amplification upweights successful trajectories to ensure positive signals guide the optimization process. Experiments on agentic and reasoning tasks demonstrate 5\% to 52\% relative improvements over baselines while maintaining training stability. Our code is released at https://github.com/shiweijiezero/R3L.

Anda Cheng, Zhen Wang, Yaliang Li et al.

Numerous research studies in the field of federated learning (FL) have attempted to use personalization to address the heterogeneity among clients, one of FL's most crucial and challenging problems. However, existing works predominantly focus on tailoring models. Yet, due to the heterogeneity of clients, they may each require different choices of hyperparameters, which have not been studied so far. We pinpoint two challenges of personalized federated hyperparameter optimization (pFedHPO): handling the exponentially increased search space and characterizing each client without compromising its data privacy. To overcome them, we propose learning a \textsc{H}yper\textsc{P}arameter \textsc{N}etwork (HPN) fed with client encoding to decide personalized hyperparameters. The client encoding is calculated with a random projection-based procedure to protect each client's privacy. Besides, we design a novel mechanism to debias the low-fidelity function evaluation samples for learning HPN. We conduct extensive experiments on FL tasks from various domains, demonstrating the superiority of HPN.

Yuntao Du, Zitao Li, Bolin Ding et al.

Impressive progress has been made in automated problem-solving by the collaboration of large language model (LLM) based agents. However, these automated capabilities also open avenues for malicious applications. In this paper, we study a new threat that LLMs pose to online pseudonymity, called automated profile inference, where an adversary can instruct LLMs to automatically collect and extract sensitive personal attributes from publicly available user activities on pseudonymous platforms. We also introduce an automated profiling framework called AutoProfiler to demonstrate and assess the feasibility of such attacks in real-world scenarios. AutoProfiler consists of four specialized LLM agents that work collaboratively to retrieve and process user online activities and generate a profile with extracted personal information. Experimental results on two real-world datasets and one synthetic dataset show that AutoProfiler is highly effective and efficient, and the inferred attributes are both identifiable and sensitive, posing significant privacy risks. We explore mitigation strategies from different perspectives and advocate for increased public awareness of this emerging privacy threat.

Qirui Jiao, Daoyuan Chen, Yilun Huang et al.

High-performance Multimodal Large Language Models (MLLMs) are heavily dependent on data quality. To advance fine-grained image recognition within MLLMs, we introduce a novel data synthesis method inspired by contrastive learning and image difference captioning. Our key idea involves challenging the model to discern both matching and distinct elements by scrutinizing object differences in detailed regions across similar images. We begin by generating pairs of similar images that emphasize object variations. Following this, we employ a Difference Area Generator to pinpoint object differences, and subsequently, a Difference Captions Generator to articulate these differences. This process results in a high-quality dataset of "object replacement" samples, termed Img-Diff, which can be scaled as needed due to its automated nature. We leverage this generated dataset to fine-tune state-of-the-art (SOTA) MLLMs, such as InternVL2, achieving substantial improvements across various image difference and Visual Question Answering tasks. Notably, the trained models significantly outperform existing SOTA models like GPT-4V and Gemini on the MMVP benchmark. Additionally, we conduct comprehensive evaluations to validate the dataset's diversity, quality, and robustness, offering several insights into the synthesis of such contrastive datasets. We release our codes and dataset to encourage further research on multimodal data synthesis and MLLMs' fundamental capabilities for image understanding.

Yanxi Chen, Yaliang Li, Bolin Ding et al.

This work presents an analytical framework for the design and analysis of LLM-based algorithms, i.e., algorithms that contain one or multiple calls of large language models (LLMs) as sub-routines and critically rely on the capabilities of LLMs. While such algorithms, ranging from basic LLM calls with prompt engineering to complicated LLM-powered agentic workflows and compound AI systems, have achieved remarkable empirical success, their design and optimization oftentimes require extensive trial-and-errors and case-by-case analysis. Our proposed framework serves as an attempt to mitigate such headaches, offering a formal and systematic approach for analyzing how the accuracy and efficiency of an LLM-based algorithm will be impacted by critical design choices, such as the pattern and granularity of task decomposition, or the prompt for each LLM call. Through a wide range of case studies covering diverse algorithm patterns (including parallel/hierarchical/recursive task decomposition and generic directed acyclic graphs), we demonstrate the proposed framework in action and derive interesting insights that generalize across scenarios, accompanied by systematic empirical validation in synthetic settings.

Yuchang Sun, Yuexiang Xie, Bolin Ding et al.

Federated learning (FL) has emerged as a promising paradigm for fine-tuning foundation models using distributed data in a privacy-preserving manner. Under limited computational resources, clients often find it more practical to fine-tune a selected subset of layers, rather than the entire model, based on their task-specific data. In this study, we provide a thorough theoretical exploration of selective layer fine-tuning in FL, emphasizing a flexible approach that allows the clients to adjust their selected layers according to their local data and resources. We theoretically demonstrate that the layer selection strategy has a significant impact on model convergence in two critical aspects: the importance of selected layers and the heterogeneous choices across clients. Drawing from these insights, we further propose a strategic layer selection method that utilizes local gradients and regulates layer selections across clients. The extensive experiments on both image and text datasets demonstrate the effectiveness of the proposed strategy compared with several baselines, highlighting its advances in identifying critical layers that adapt to the client heterogeneity and training dynamics in FL.

Dawei Gao, Zitao Li, Xuchen Pan et al.

With the rapid advancement of Large Language Models (LLMs), significant progress has been made in multi-agent applications. However, the complexities in coordinating agents' cooperation and LLMs' erratic performance pose notable challenges in developing robust and efficient multi-agent applications. To tackle these challenges, we propose AgentScope, a developer-centric multi-agent platform with message exchange as its core communication mechanism. The abundant syntactic tools, built-in agents and service functions, user-friendly interfaces for application demonstration and utility monitor, zero-code programming workstation, and automatic prompt tuning mechanism significantly lower the barriers to both development and deployment. Towards robust and flexible multi-agent application, AgentScope provides both built-in and customizable fault tolerance mechanisms. At the same time, it is also armed with system-level support for managing and utilizing multi-modal data, tools, and external knowledge. Additionally, we design an actor-based distribution framework, enabling easy conversion between local and distributed deployments and automatic parallel optimization without extra effort. With these features, AgentScope empowers developers to build applications that fully realize the potential of intelligent agents. We have released AgentScope at https://github.com/modelscope/agentscope, and hope AgentScope invites wider participation and innovation in this fast-moving field.

Yi Yu, Liuyi Yao, Yuexiang Xie et al.

Large language model (LLM) agents face fundamental limitations in long-horizon reasoning due to finite context windows, making effective memory management critical. Existing methods typically handle long-term memory (LTM) and short-term memory (STM) as separate components, relying on heuristics or auxiliary controllers, which limits adaptability and end-to-end optimization. In this paper, we propose Agentic Memory (AgeMem), a unified framework that integrates LTM and STM management directly into the agent's policy. AgeMem exposes memory operations as tool-based actions, enabling the LLM agent to autonomously decide what and when to store, retrieve, update, summarize, or discard information. To train such unified behaviors, we propose a three-stage progressive reinforcement learning strategy and design a step-wise GRPO to address sparse and discontinuous rewards induced by memory operations. Experiments on five long-horizon benchmarks demonstrate that AgeMem consistently outperforms strong memory-augmented baselines across multiple LLM backbones, achieving improved task performance, higher-quality long-term memory, and more efficient context usage.

Yanxi Chen, Xuchen Pan, Yaliang Li et al.

We present EE-LLM, a framework for large-scale training and inference of early-exit large language models (LLMs). While recent works have shown preliminary evidence for the efficacy of early exiting in accelerating LLM inference, EE-LLM makes a foundational step towards scaling up early-exit LLMs by supporting their training and inference with massive 3D parallelism. Built upon Megatron-LM, EE-LLM implements a variety of algorithmic innovations and performance optimizations tailored to early exiting, including a lightweight method that facilitates backpropagation for the early-exit training objective with pipeline parallelism, techniques of leveraging idle resources in the original pipeline schedule for computation related to early-exit layers, and two approaches of early-exit inference that are compatible with KV caching for autoregressive generation. Our analytical and empirical study shows that EE-LLM achieves great training efficiency with negligible computational overhead compared to standard LLM training, as well as outstanding inference speedup without compromising output quality. To facilitate further research and adoption, we release EE-LLM at https://github.com/pan-x-c/EE-LLM.

Jinhao Jiang, Kun Zhou, Wayne Xin Zhao et al.

Question Answering over Knowledge Graph (KGQA) aims to seek answer entities for the natural language question from a large-scale Knowledge Graph~(KG). To better perform reasoning on KG, recent work typically adopts a pre-trained language model~(PLM) to model the question, and a graph neural network~(GNN) based module to perform multi-hop reasoning on the KG. Despite the effectiveness, due to the divergence in model architecture, the PLM and GNN are not closely integrated, limiting the knowledge sharing and fine-grained feature interactions. To solve it, we aim to simplify the above two-module approach, and develop a more capable PLM that can directly support subgraph reasoning for KGQA, namely ReasoningLM. In our approach, we propose a subgraph-aware self-attention mechanism to imitate the GNN for performing structured reasoning, and also adopt an adaptation tuning strategy to adapt the model parameters with 20,000 subgraphs with synthesized questions. After adaptation, the PLM can be parameter-efficient fine-tuned on downstream tasks. Experiments show that ReasoningLM surpasses state-of-the-art models by a large margin, even with fewer updated parameters and less training data. Our codes and data are publicly available at~\url{https://github.com/RUCAIBox/ReasoningLM}.

Shumin Wang, Yuexiang Xie, Wenhao Zhang et al.

Entropy serves as a critical metric for measuring the diversity of outputs generated by large language models (LLMs), providing valuable insights into their exploration capabilities. While recent studies increasingly focus on monitoring and adjusting entropy to better balance exploration and exploitation in reinforcement fine-tuning (RFT), a principled understanding of entropy dynamics during this process is yet to be thoroughly investigated. In this paper, we establish a theoretical framework for analyzing the entropy dynamics during the RFT process, which begins with a discriminant expression that quantifies entropy change under a single logit update. This foundation enables the derivation of a first-order expression for entropy change, which can be further extended to the update formula of Group Relative Policy Optimization (GRPO). The corollaries and insights drawn from the theoretical analysis inspire the design of entropy control methods, and also offer a unified lens for interpreting various entropy-based methods in existing studies. We provide empirical evidence to support the main conclusions of our analysis and demonstrate the effectiveness of the derived entropy-discriminator clipping methods. This study yields novel insights into RFT training dynamics, providing theoretical support and practical strategies for optimizing the exploration-exploitation balance during LLM fine-tuning.

Xinyu Tang, Xiaolei Wang, Wayne Xin Zhao et al.

Automatic prompt optimization is an important approach to improving the performance of large language models (LLMs). Recent research demonstrates the potential of using LLMs as prompt optimizers, which can generate improved task prompts via iterative refinement. In this paper, we propose a novel perspective to investigate the design of LLM-based prompt optimizers, by drawing an analogy with gradient-based model optimizers. To connect these two approaches, we identify two pivotal factors in model parameter learning: update direction and update method. By systematically analyzing a rich set of improvement strategies on the two aspects, we further develop a capable Gradient-inspired LLM-based Prompt Optimizer called GPO. At each step, it first retrieves relevant prompts from the optimization trajectory as the update direction. Then, it utilizes the generation-based refinement strategy to perform the update, while controlling the edit distance through a cosine-based decay strategy. Extensive experiments demonstrate the effectiveness and efficiency of GPO. In particular, GPO brings an additional improvement of up to 56.8% on Big-Bench Hard and 62.6% on MMLU compared to baseline methods. The code is available at https://github.com/RUCAIBox/GPO.

Wenhao Zhang, Yuexiang Xie, Yuchang Sun et al.

Supervised Fine-Tuning (SFT) and Reinforcement Learning (RL) are two prominent post-training paradigms for refining the capabilities and aligning the behavior of Large Language Models (LLMs). Existing approaches that integrate SFT and RL often face the risk of disrupting established response patterns and inducing overfitting to expert data. To address this, we present a novel investigation into the unified view of SFT and RL through an off-policy versus on-policy lens. We propose CHORD, a framework for Controllable Harmonization of On- and Off-Policy Reinforcement Learning via Dynamic Weighting, which reframes SFT not as a separate stage but as a dynamically weighted auxiliary objective within the on-policy RL process. Based on an analysis of off-policy expert data's influence at both holistic and granular levels, we incorporate a dual-control mechanism in CHORD. Specifically, the framework first employs a global coefficient to holistically guide the transition from off-policy imitation to on-policy exploration, and then applies a token-wise weighting function that enables granular learning from the expert, which promotes on-policy exploration and mitigates disruption from off-policy data. We conduct extensive experiments on mathematical reasoning problems and practical tool-use tasks, providing empirical evidence that CHORD achieves a stable and efficient learning process. By effectively harmonizing off-policy expert data with on-policy exploration, CHORD demonstrates significant improvements over baselines. We release the implementation at https://github.com/modelscope/Trinity-RFT/tree/main/examples/mix_chord to inspire further research.

Die Chen, Zhiwen Li, Mingyuan Fan et al.

Despite their remarkable image generation capabilities, text-to-image diffusion models inadvertently learn inappropriate concepts from vast and unfiltered training data, which leads to various ethical and business risks. Specifically, model-generated images may exhibit not safe for work (NSFW) content and style copyright infringements. The prompts that result in these problems often do not include explicit unsafe words; instead, they contain obscure and associative terms, which are referred to as implicit unsafe prompts. Existing approaches directly fine-tune models under textual guidance to alter the cognition of the diffusion model, thereby erasing inappropriate concepts. This not only requires concept-specific fine-tuning but may also incur catastrophic forgetting. To address these issues, we explore the representation of inappropriate concepts in the image space and guide them towards more suitable ones by injecting growth inhibitors, which are tailored based on the identified features related to inappropriate concepts during the diffusion process. Additionally, due to the varying degrees and scopes of inappropriate concepts, we train an adapter to infer the corresponding suppression scale during the injection process. Our method effectively captures the manifestation of subtle words at the image level, enabling direct and efficient erasure of target concepts without the need for fine-tuning. Through extensive experimentation, we demonstrate that our approach achieves superior erasure results with little effect on other concepts while preserving image quality and semantics.

Jinyan Ye, Zhongjie Duan, Zhiwen Li et al.

Inference-time scaling offers a versatile paradigm for aligning visual generative models with downstream objectives without parameter updates. However, existing approaches that optimize the high-dimensional initial noise suffer from severe inefficiency, as many search directions exert negligible influence on the final generation. We show that this inefficiency is closely related to a spectral bias in generative dynamics: model sensitivity to initial perturbations diminishes rapidly as frequency increases. Building on this insight, we propose Spectral Evolution Search (SES), a plug-and-play framework for initial noise optimization that executes gradient-free evolutionary search within a low-frequency subspace. Theoretically, we derive the Spectral Scaling Prediction from perturbation propagation dynamics, which explains the systematic differences in the impact of perturbations across frequencies. Extensive experiments demonstrate that SES significantly advances the Pareto frontier of generation quality versus computational cost, consistently outperforming strong baselines under equivalent budgets.

Haohao Luo, Zexi Li, Yuexiang Xie et al.

Deep Research (DR) agents extend Large Language Models (LLMs) beyond parametric knowledge by autonomously retrieving and synthesizing evidence from large web corpora into long-form reports, enabling a long-horizon agentic paradigm. However, unlike real-time conversational assistants, DR is computationally expensive and time-consuming, creating an autonomy-interaction dilemma: high autonomy on ambiguous user queries often leads to prolonged execution with unsatisfactory outcomes. To address this, we propose IntentRL, a framework that trains proactive agents to clarify latent user intents before starting long-horizon research. To overcome the scarcity of open-ended research data, we introduce a scalable pipeline that expands a few seed samples into high-quality dialogue turns via a shallow-to-deep intent refinement graph. We further adopt a two-stage reinforcement learning (RL) strategy: Stage I applies RL on offline dialogues to efficiently learn general user-interaction behavior, while Stage II uses the trained agent and a user simulator for online rollouts to strengthen adaptation to diverse user feedback. Extensive experiments show that IntentRL significantly improves both intent hit rate and downstream task performance, outperforming the built-in clarify modules of closed-source DR agents and proactive LLM baselines.

Qianli Shen, Daoyuan Chen, Yilun Huang et al.

Reinforcement finetuning (RFT) is a key technique for aligning Large Language Models (LLMs) with human preferences and enhancing reasoning, yet its effectiveness is highly sensitive to which tasks are explored during training. Uniform task sampling is inefficient, wasting computation on tasks that are either trivial or unsolvable, while existing task selection methods often suffer from high rollout costs, poor adaptivity, or incomplete evidence. We introduce BOTS, a unified framework for Bayesian Online Task Selection in LLM reinforcement finetuning. Grounded in Bayesian inference, BOTS adaptively maintains posterior estimates of task difficulty as the model evolves. It jointly incorporates explicit evidence from direct evaluations of selected tasks and implicit evidence inferred from these evaluations for unselected tasks, with Thompson sampling ensuring a principled balance between exploration and exploitation. To make implicit evidence practical, we instantiate it with an ultra-light interpolation-based plug-in that estimates difficulties of unevaluated tasks without extra rollouts, adding negligible overhead. Empirically, across diverse domains and LLM scales, BOTS consistently improves data efficiency and performance over baselines and ablations, providing a practical and extensible solution for dynamic task selection in RFT.

Qirui Jiao, Daoyuan Chen, Yilun Huang et al.

Despite the impressive capabilities of Multimodal Large Language Models (MLLMs) in integrating text and image modalities, challenges remain in accurately interpreting detailed visual elements. Vision detection models excel at recognizing fine-grained image details, prompting researchers to use them to enhance MLLMs. One effective strategy is to infuse detection information in text format, which has proven simple and effective. However, most studies utilize this method without training, leaving the potential of adaptive training largely unexplored. Adaptive training could significantly enhance MLLMs' comprehension of unique inputs while filtering out irrelevant information. This paper addresses the crucial question: How does training impact MLLMs' understanding of infused textual detection information? We systematically experiment with various representative models to evaluate the effects of training-free, retraining, and fine-tuning strategies. We also examine the influence of training on MLLMs' original abilities and the interchangeability of detection models. Our findings indicate that fine-tuning a pre-trained MLLM to incorporate textual detection information delivers superior results compared to training-free and retraining methods, improving performance by 6.71% across 10 widely recognized benchmarks. Furthermore, fine-tuning enables MLLMs to retain performance enhancements even when detection models are swapped, indicating improved understanding of formatted textual data. We release our codes to support further exploration of fusion strategies for vision detection models and the enhancement of MLLMs' fine-grained multimodal capabilities.

Ting Zhou, Daoyuan Chen, Qirui Jiao et al.

In the domain of Multimodal Large Language Models (MLLMs), achieving human-centric video understanding remains a formidable challenge. Existing benchmarks primarily emphasize object and action recognition, often neglecting the intricate nuances of human emotions, behaviors, and speech-visual alignment within video content. We present HumanVBench, an innovative benchmark meticulously crafted to bridge these gaps in the evaluation of video MLLMs. HumanVBench comprises 16 carefully designed tasks that explore two primary dimensions: inner emotion and outer manifestations, spanning static and dynamic, basic and complex, as well as single-modal and cross-modal aspects. With two advanced automated pipelines for video annotation and distractor-included QA generation, HumanVBench utilizes diverse state-of-the-art (SOTA) techniques to streamline benchmark data synthesis and quality assessment, minimizing human annotation dependency tailored to human-centric multimodal attributes. A comprehensive evaluation across 22 SOTA video MLLMs reveals notable limitations in current performance, especially in cross-modal and emotion perception, underscoring the necessity for further refinement toward achieving more human-like understanding. HumanVBench is open-sourced to facilitate future advancements and real-world applications in video MLLMs.

Anjie Qiao, Zhen Wang, Yaliang Li et al.

Virtual screening aims to efficiently identify active ligands from massive chemical libraries for a given target pocket. Recent CLIP-style models such as DrugCLIP enable scalable virtual screening by embedding pockets and ligands into a shared space. However, our analyses indicate that such representations can be insensitive to fine-grained binding interactions and may rely on shortcut correlations in training data, limiting their ability to rank ligands by true binding compatibility. To address these issues, we propose BindCLIP, a unified contrastive-generative representation learning framework for virtual screening. BindCLIP jointly trains pocket and ligand encoders using CLIP-style contrastive learning together with a pocket-conditioned diffusion objective for binding pose generation, so that pose-level supervision directly shapes the retrieval embedding space toward interaction-relevant features. To further mitigate shortcut reliance, we introduce hard-negative augmentation and a ligand-ligand anchoring regularizer that prevents representation collapse. Experiments on two public benchmarks demonstrate consistent improvements over strong baselines. BindCLIP achieves substantial gains on challenging out-of-distribution virtual screening and improves ligand-analogue ranking on the FEP+ benchmark. Together, these results indicate that integrating generative, pose-level supervision with contrastive learning yields more interaction-aware embeddings and improves generalization in realistic screening settings, bringing virtual screening closer to real-world applicability.

Xuchen Pan, Yanxi Chen, Yaliang Li et al.

This work introduces EE-Tuning, a lightweight and economical solution to training/tuning early-exit large language models (LLMs). In contrast to the common approach of full-parameter pre-training, EE-Tuning augments any pre-trained (and possibly fine-tuned) standard LLM with additional early-exit layers that are tuned in a parameter-efficient manner, which requires significantly less computational resources and training data. Our implementation of EE-Tuning achieves outstanding training efficiency via extensive performance optimizations, as well as scalability due to its full compatibility with 3D parallelism. Results of systematic experiments validate the efficacy of EE-Tuning, confirming that effective early-exit LLM inference can be achieved with a limited training budget. In hope of making early-exit LLMs accessible to the community, we release the source code of our implementation of EE-Tuning at https://github.com/pan-x-c/EE-LLM.

Jiarui Ji, Runlin Lei, Xuchen Pan et al.

The emergence of Large Language Models (LLMs) demonstrates their potential to encapsulate the logic and patterns inherent in human behavior simulation by leveraging extensive web data pre-training. However, the boundaries of LLM capabilities in social simulation remain unclear. To further explore the social attributes of LLMs, we introduce the CiteAgent framework, designed to generate citation networks based on human-behavior simulation with LLM-based agents. CiteAgent successfully captures predominant phenomena in real-world citation networks, including power-law distribution, citational distortion, and shrinking diameter. Building on this realistic simulation, we establish two LLM-based research paradigms in social science: LLM-SE (LLM-based Survey Experiment) and LLM-LE (LLM-based Laboratory Experiment). These paradigms facilitate rigorous analyses of citation network phenomena, allowing us to validate and challenge existing theories. Additionally, we extend the research scope of traditional science of science studies through idealized social experiments, with the simulation experiment results providing valuable insights for real-world academic environments. Our work demonstrates the potential of LLMs for advancing science of science research in social science.

Zhenqing Ling, Daoyuan Chen, Liuyi Yao et al.

Fine-tuning large language models (LLMs) using diverse datasets is crucial for enhancing their overall performance across various domains. In practical scenarios, existing methods based on modeling the mixture proportions of data composition often struggle with data whose domain labels are missing, imprecise or non-normalized, while methods based on data selection usually encounter difficulties in balancing multi-domain performance. To address these challenges, in this work, we investigate the role of data diversity in enhancing the overall abilities of LLMs by empirically constructing contrastive data pools and theoretically deriving explanations. Building upon the insights gained, we propose a new method that gives the LLM a dual identity: an output model to cognitively probe and select data based on diversity reward, as well as an input model to be tuned with the selected data. Extensive experiments show that the proposed method notably boosts performance across domain-undetermined data and a series of foundational downstream tasks when applied to various advanced LLMs. We release our code and hope this study can shed light on the understanding of data diversity and advance feedback-driven data-model co-design for LLMs.