arXiv subjects

Zhiyuan Liu

Publications and source records attributed to Zhiyuan Liu.

At least 217 records · Page 12Linked to original sources

arXiv2025

Migician: Revealing the Magic of Free-Form Multi-Image Grounding in Multimodal Large Language Models

The recent advancement of Multimodal Large Language Models (MLLMs) has significantly improved their fine-grained perception of single images and general comprehension across multiple images. However, existing MLLMs still face challenges in achieving precise grounding in complex multi-image scenarios. To address this, we first explore a Chain-of-Thought (CoT) framework that integrates single-image grounding with multi-image comprehension. While partially effective, it remains unstable and struggles to capture abstract visual information due to its non-end-to-end nature. Therefore, we introduce Migician, the first multi-image grounding model capable of performing free-form and accurate grounding across multiple images. To support this, we present the MGrounding-630k dataset, which comprises data for several multi-image grounding tasks derived from existing datasets, along with newly generated free-form grounding instruction-following data. Furthermore, we propose MIG-Bench, a comprehensive benchmark specifically designed for evaluating multi-image grounding capabilities. Experimental results demonstrate that our model achieves significantly superior multi-image grounding capabilities, outperforming the best existing MLLMs by 24.94% and even surpassing much larger 70B models. Our code, model, dataset, and benchmark are fully open-sourced at https://migician-vg.github.io/.

cs.CL↗

arXiv2025

Diffusion Models for Molecules: A Survey of Methods and Tasks

Generative tasks about molecules, including but not limited to molecule generation, are crucial for drug discovery and material design, and have consistently attracted significant attention. In recent years, diffusion models have emerged as an impressive class of deep generative models, sparking extensive research and leading to numerous studies on their application to molecular generative tasks. Despite the proliferation of related work, there remains a notable lack of up-to-date and systematic surveys in this area. Particularly, due to the diversity of diffusion model formulations, molecular data modalities, and generative task types, the research landscape is challenging to navigate, hindering understanding and limiting the area's growth. To address this, this paper conducts a comprehensive survey of diffusion model-based molecular generative methods. We systematically review the research from the perspectives of methodological formulations, data modalities, and task types, offering a novel taxonomy. This survey aims to facilitate understanding and further flourishing development in this area. The relevant papers are summarized at: https://github.com/AzureLeon1/awesome-molecular-diffusion-models.

cs.LG↗

arXiv2025

COAST: Enhancing the Code Debugging Ability of LLMs through Communicative Agent Based Data Synthesis

Code debugging is a vital stage of software development, essential for ensuring the reliability and performance of Large Language Models (LLMs) in the code generation task. Human debugging typically follows a multi-stage process, which includes Bug Localization, Bug Identification, Code Repair, and Code Recognition. However, existing code debugging benchmarks predominantly focus on the Code Repair stage, which offers only a limited perspective on evaluating the debugging capabilities of LLMs. In this paper, we introduce DEBUGEVAL, a comprehensive benchmark for evaluating the debugging abilities of LLMs by emulating the multi-stage human debugging process. Through evaluating on DEBUGEVAL, we observe that 7B-scale models consistently underperform compared to their larger counterparts, highlighting their limitations in comprehending code semantics. In this case, we propose the COmmunicative Agent-based data SynThesis (COAST) framework, which employs a multi-agent system to generate high-quality training data for supervised fine-tuning (SFT). Experimental results demonstrate that COAST-generated data outperform human-curated and GPT-4-generated data, enabling 7B-scale LLMs to achieve debugging performance comparable to GPT-3.5. All data and codes are available at https://github.com/NEUIR/COAST.

cs.SE↗

arXiv2025

Locret: Enhancing Eviction in Long-Context LLM Inference with Trained Retaining Heads on Consumer-Grade Devices

Scaling the input context length of a large language model (LLM) incurs a significant increase in computation cost and memory footprint to maintain the attention key-value (KV) cache. Existing KV cache compression methods suffer from inefficient compression strategies and limited memory reduction effects, making it difficult for LLMs to conduct long-context inference on consumer-grade devices, especially when inferring long-context stream input. Such obstacles prevent consumer-grade devices from supporting more complex applications, creating challenges for the democratization of LLMs. To overcome this, we propose Locret, the first framework to create an eviction policy compatible with chunked prefill. By evaluating the causal importance of KV cache units by learnable retaining heads, Locret enables precise eviction of cache units, facilitating efficient long-context inference. In our extensive empirical studies, Locret outperforms the recent popular and competitive approaches in terms of memory efficiency and generation quality -- Locret achieves up to 20x of KV cache compression ratio within less than 10% performance loss. Furthermore, Locret achieves 128K+ long-context inference on a single NVIDIA 4090 GPU without compromising generation quality and only costs <1 GPU hour of additional training.

cs.CL↗

arXiv2025

Yi-Lightning Technical Report

This technical report presents Yi-Lightning, our latest flagship large language model (LLM). It achieves exceptional performance, ranking 6th overall on Chatbot Arena, with particularly strong results (2nd to 4th place) in specialized categories including Chinese, Math, Coding, and Hard Prompts. Yi-Lightning leverages an enhanced Mixture-of-Experts (MoE) architecture, featuring advanced expert segmentation and routing mechanisms coupled with optimized KV-caching techniques. Our development process encompasses comprehensive pre-training, supervised fine-tuning (SFT), and reinforcement learning from human feedback (RLHF), where we devise deliberate strategies for multi-stage training, synthetic data construction, and reward modeling. Furthermore, we implement RAISE (Responsible AI Safety Engine), a four-component framework to address safety issues across pre-training, post-training, and serving phases. Empowered by our scalable super-computing infrastructure, all these innovations substantially reduce training, deployment and inference costs while maintaining high-performance standards. With further evaluations on public academic benchmarks, Yi-Lightning demonstrates competitive performance against top-tier LLMs, while we observe a notable disparity between traditional, static benchmark results and real-world, dynamic human preferences. This observation prompts a critical reassessment of conventional benchmarks' utility in guiding the development of more intelligent and powerful AI systems for practical applications. Yi-Lightning is now available through our developer platform at https://platform.lingyiwanwu.com.

cs.CL↗

arXiv2025

Yi: Open Foundation Models by 01.AI

We introduce the Yi model family, a series of language and multimodal models that demonstrate strong multi-dimensional capabilities. The Yi model family is based on 6B and 34B pretrained language models, then we extend them to chat models, 200K long context models, depth-upscaled models, and vision-language models. Our base models achieve strong performance on a wide range of benchmarks like MMLU, and our finetuned chat models deliver strong human preference rate on major evaluation platforms like AlpacaEval and Chatbot Arena. Building upon our scalable super-computing infrastructure and the classical transformer architecture, we attribute the performance of Yi models primarily to its data quality resulting from our data-engineering efforts. For pretraining, we construct 3.1 trillion tokens of English and Chinese corpora using a cascaded data deduplication and quality filtering pipeline. For finetuning, we polish a small scale (less than 10K) instruction dataset over multiple iterations such that every single instance has been verified directly by our machine learning engineers. For vision-language, we combine the chat language model with a vision transformer encoder and train the model to align visual representations to the semantic space of the language model. We further extend the context length to 200K through lightweight continual pretraining and demonstrate strong needle-in-a-haystack retrieval performance. We show that extending the depth of the pretrained checkpoint through continual pretraining further improves performance. We believe that given our current results, continuing to scale up model parameters using thoroughly optimized data will lead to even stronger frontier models.

cs.CL↗

arXiv2025

Intelligent System for Automated Molecular Patent Infringement Assessment

Automated drug discovery offers significant potential for accelerating the development of novel therapeutics by substituting labor-intensive human workflows with machine-driven processes. However, molecules generated by artificial intelligence may unintentionally infringe on existing patents, posing legal and financial risks that impede the full automation of drug discovery pipelines. This paper introduces PatentFinder, a novel multi-agent and tool-enhanced intelligence system that can accurately and comprehensively evaluate small molecules for patent infringement. PatentFinder features five specialized agents that collaboratively analyze patent claims and molecular structures with heuristic and model-based tools, generating interpretable infringement reports. To support systematic evaluation, we curate MolPatent-240, a benchmark dataset tailored for patent infringement assessment algorithms. On this benchmark, PatentFinder outperforms baseline methods that rely solely on large language models or specialized chemical tools, achieving a 13.8% improvement in F1-score and a 12% increase in accuracy. Additionally, PatentFinder autonomously generates detailed and interpretable patent infringement reports, showcasing enhanced accuracy and improved interpretability. The high accuracy and interpretability of PatentFinder make it a valuable and reliable tool for automating patent infringement assessments, offering a practical solution for integrating patent protection analysis into the drug discovery pipeline.

cs.LG↗

arXiv2025

ProSparse: Introducing and Enhancing Intrinsic Activation Sparsity within Large Language Models

Activation sparsity refers to the existence of considerable weakly-contributed elements among activation outputs. As a prevalent property of the models using the ReLU activation function, activation sparsity has been proven a promising paradigm to boost model inference efficiency. Nevertheless, most large language models (LLMs) adopt activation functions without intrinsic activation sparsity (e.g., GELU and Swish). Some recent efforts have explored introducing ReLU or its variants as the substitutive activation function to help LLMs achieve activation sparsity and inference acceleration, but few can simultaneously obtain high sparsity and comparable model performance. This paper introduces a simple and effective sparsification method named "ProSparse" to push LLMs for higher activation sparsity while maintaining comparable performance. Specifically, after substituting the activation function of LLMs with ReLU, ProSparse adopts progressive sparsity regularization with a factor smoothly increasing along the multi-stage sine curves. This can enhance activation sparsity and mitigate performance degradation by avoiding radical shifts in activation distributions. With ProSparse, we obtain high sparsity of 89.32% for LLaMA2-7B, 88.80% for LLaMA2-13B, and 87.89% for end-size MiniCPM-1B, respectively, achieving comparable performance to their original Swish-activated versions. These present the most sparsely activated models among open-source LLaMA versions and competitive end-size models, considerably surpassing ReluLLaMA-7B (66.98%) and ReluLLaMA-13B (71.56%). Our inference acceleration experiments further demonstrate the significant practical acceleration potential of LLMs with higher activation sparsity, obtaining up to 4.52$\times$ inference speedup.

cs.LG↗

arXiv2024

Graph Coarsening via Supervised Granular-Ball for Scalable Graph Neural Network Training

Graph Neural Networks (GNNs) have demonstrated significant achievements in processing graph data, yet scalability remains a substantial challenge. To address this, numerous graph coarsening methods have been developed. However, most existing coarsening methods are training-dependent, leading to lower efficiency, and they all require a predefined coarsening rate, lacking an adaptive approach. In this paper, we employ granular-ball computing to effectively compress graph data. We construct a coarsened graph network by iteratively splitting the graph into granular-balls based on a purity threshold and using these granular-balls as super vertices. This granulation process significantly reduces the size of the original graph, thereby greatly enhancing the training efficiency and scalability of GNNs. Additionally, our algorithm can adaptively perform splitting without requiring a predefined coarsening rate. Experimental results demonstrate that our method achieves accuracy comparable to training on the original graph. Noise injection experiments further indicate that our method exhibits robust performance. Moreover, our approach can reduce the graph size by up to 20 times without compromising test accuracy, substantially enhancing the scalability of GNNs.

cs.LG↗

arXiv2024

Densing Law of LLMs

Large Language Models (LLMs) have emerged as a milestone in artificial intelligence, and their performance can improve as the model size increases. However, this scaling brings great challenges to training and inference efficiency, particularly for deploying LLMs in resource-constrained environments, and the scaling trend is becoming increasingly unsustainable. This paper introduces the concept of ``\textit{capacity density}'' as a new metric to evaluate the quality of the LLMs across different scales and describes the trend of LLMs in terms of both effectiveness and efficiency. To calculate the capacity density of a given target LLM, we first introduce a set of reference models and develop a scaling law to predict the downstream performance of these reference models based on their parameter sizes. We then define the \textit{effective parameter size} of the target LLM as the parameter size required by a reference model to achieve equivalent performance, and formalize the capacity density as the ratio of the effective parameter size to the actual parameter size of the target LLM. Capacity density provides a unified framework for assessing both model effectiveness and efficiency. Our further analysis of recent open-source base LLMs reveals an empirical law (the densing law)that the capacity density of LLMs grows exponentially over time. More specifically, using some widely used benchmarks for evaluation, the capacity density of LLMs doubles approximately every three months. The law provides new perspectives to guide future LLM development, emphasizing the importance of improving capacity density to achieve optimal results with minimal computational overhead.

cs.AI↗

arXiv2024

A dynamical measure of algorithmically infused visibility

This work focuses on the nature of visibility in societies where the behaviours of humans and algorithms influence each other - termed algorithmically infused societies. We propose a quantitative measure of visibility, with implications and applications to an array of disciplines including communication studies, political science, marketing, technology design, and social media analytics. The measure captures the basic characteristics of the visibility of a given topic, in algorithm/AI-mediated communication/social media settings. Topics, when trending, are ranked against each other, and the proposed measure combines the following two attributes of a topic: (i) the amount of time a topic spends at different ranks, and (ii) the different ranks the topic attains. The proposed measure incorporates a tunable parameter, termed the discrimination level, whose value determines the relative weights of the two attributes that contribute to visibility. Analysis of a large-scale, real-time dataset of trending topics, from one of the largest social media platforms, demonstrates that the proposed measure can explain a large share of the variability of the accumulated views of a topic.

cs.SI↗

arXiv2024

Proactive Agent: Shifting LLM Agents from Reactive Responses to Active Assistance

Agents powered by large language models have shown remarkable abilities in solving complex tasks. However, most agent systems remain reactive, limiting their effectiveness in scenarios requiring foresight and autonomous decision-making. In this paper, we tackle the challenge of developing proactive agents capable of anticipating and initiating tasks without explicit human instructions. We propose a novel data-driven approach for this problem. Firstly, we collect real-world human activities to generate proactive task predictions. These predictions are then labeled by human annotators as either accepted or rejected. The labeled data is used to train a reward model that simulates human judgment and serves as an automatic evaluator of the proactiveness of LLM agents. Building on this, we develop a comprehensive data generation pipeline to create a diverse dataset, ProactiveBench, containing 6,790 events. Finally, we demonstrate that fine-tuning models with the proposed ProactiveBench can significantly elicit the proactiveness of LLM agents. Experimental results show that our fine-tuned model achieves an F1-Score of 66.47% in proactively offering assistance, outperforming all open-source and close-source models. These results highlight the potential of our method in creating more proactive and effective agent systems, paving the way for future advancements in human-agent collaboration.

cs.AI↗

arXiv2024

Free Process Rewards without Process Labels

Different from its counterpart outcome reward models (ORMs), which evaluate the entire responses, a process reward model (PRM) scores a reasoning trajectory step by step, providing denser and more fine grained rewards. However, training a PRM requires labels annotated at every intermediate step, presenting significant challenges for both manual and automatic data collection. This paper aims to address this challenge. Both theoretically and empirically, we show that an \textit{implicit PRM} can be obtained at no additional cost, by simply training an ORM on the cheaper response-level labels. The only assumption is to parameterize the outcome reward as the log-likelihood ratios of the policy and reference models, which can be optimized regardless of the specific choice of loss objectives. In experiments, we instantiate our implicit PRMs with various objectives and evaluate their performance on MATH. We show that our implicit PRM outperforms a strong MCTS-based baseline \textit{á la} Math-Shepherd using less than $1/38$ of the training data. Its performance can be further improved with majority voting. We further find that scaling up instructions and responses benefits our implicit PRM, and the latter brings a larger gain. Particularly, we find that our implicit PRM, when instantiated with the cross-entropy (CE) loss, is more data-efficient and can keep improving generation models even when trained with only one response per instruction, the setup that suffers from extreme data scarcity and imbalance. Further, instructions should be relevant to downstream tasks while the diversity of responses does not bring gains. Surprisingly, training on extra Math-Shepherd step labels brings no further improvements to our implicit PRM trained on only outcome data. We hope that our work will encourage a rethinking of PRM training approaches and contribute to making training PRMs more accessible.

cs.LG↗

arXiv2024

OneBit: Towards Extremely Low-bit Large Language Models

Model quantification uses low bit-width values to represent the weight matrices of existing models to be quantized, which is a promising approach to reduce both storage and computational overheads of deploying highly anticipated LLMs. However, current quantization methods suffer severe performance degradation when the bit-width is extremely reduced, and thus focus on utilizing 4-bit or 8-bit values to quantize models. This paper boldly quantizes the weight matrices of LLMs to 1-bit, paving the way for the extremely low bit-width deployment of LLMs. For this target, we introduce a 1-bit model compressing framework named OneBit, including a novel 1-bit parameter representation method to better quantize LLMs as well as an effective parameter initialization method based on matrix decomposition to improve the convergence speed of the quantization framework. Sufficient experimental results indicate that OneBit achieves good performance (at least 81% of the non-quantized performance on LLaMA models) with robust training processes when only using 1-bit weight matrices.

cs.CL↗

arXiv2024

Simulating Classroom Education with LLM-Empowered Agents

Large language models (LLMs) have been applied across various intelligent educational tasks to assist teaching. While preliminary studies have focused on task-specific, independent LLM-empowered agents, the potential of LLMs within a multi-agent collaborative framework for classroom simulation with real user participation remains unexplored. In this work, we propose SimClass, a multi-agent classroom simulation teaching framework. We recognize representative class roles and introduce a novel class control mechanism for automatic classroom teaching, and conduct user experiments in two real-world courses. Using the Flanders Interactive Analysis System and Community of Inquiry theoretical frameworks from educational analysis, we demonstrate that LLMs can simulate a dynamic learning environment for users with active teacher-student and student-student interactions. We also observe group behaviors among agents in SimClass, where agents collaborate to create enlivening interactions in classrooms to improve user learning process. We hope this work pioneers the application of LLM-empowered multi-agent systems in virtual classroom teaching.

cs.CL↗

arXiv2024

Delta-CoMe: Training-Free Delta-Compression with Mixed-Precision for Large Language Models

Fine-tuning is a crucial process for adapting large language models (LLMs) to diverse applications. In certain scenarios, such as multi-tenant serving, deploying multiple LLMs becomes necessary to meet complex demands. Recent studies suggest decomposing a fine-tuned LLM into a base model and corresponding delta weights, which are then compressed using low-rank or low-bit approaches to reduce costs. In this work, we observe that existing low-rank and low-bit compression methods can significantly harm the model performance for task-specific fine-tuned LLMs (e.g., WizardMath for math problems). Motivated by the long-tail distribution of singular values in the delta weights, we propose a delta quantization approach using mixed-precision. This method employs higher-bit representation for singular vectors corresponding to larger singular values. We evaluate our approach on various fine-tuned LLMs, including math LLMs, code LLMs, chat LLMs, and even VLMs. Experimental results demonstrate that our approach performs comparably to full fine-tuned LLMs, surpassing both low-rank and low-bit baselines by a considerable margin. Additionally, we show that our method is compatible with various backbone LLMs, such as Llama-2, Llama-3, and Mistral, highlighting its generalizability.

cs.CL↗

arXiv2024

Universal Photorealistic Style Transfer: A Lightweight and Adaptive Approach

Photorealistic style transfer aims to apply stylization while preserving the realism and structure of input content. However, existing methods often encounter challenges such as color tone distortions, dependency on pair-wise pre-training, inefficiency with high-resolution inputs, and the need for additional constraints in video style transfer tasks. To address these issues, we propose a Universal Photorealistic Style Transfer (UPST) framework that delivers accurate photorealistic style transfer on high-resolution images and videos without relying on pre-training. Our approach incorporates a lightweight StyleNet for per-instance transfer, ensuring color tone accuracy while supporting high-resolution inputs, maintaining rapid processing speeds, and eliminating the need for pretraining. To further enhance photorealism and efficiency, we introduce instance-adaptive optimization, which features an adaptive coefficient to prioritize content image realism and employs early stopping to accelerate network convergence. Additionally, UPST enables seamless video style transfer without additional constraints due to its strong non-color information preservation ability. Experimental results show that UPST consistently produces photorealistic outputs and significantly reduces GPU memory usage, making it an effective and universal solution for various photorealistic style transfer tasks.

cs.CV↗

arXiv2024

Seq1F1B: Efficient Sequence-Level Pipeline Parallelism for Large Language Model Training

The emergence of large language models (LLMs) relies heavily on distributed training strategies, among which pipeline parallelism plays a crucial role. As LLMs' training sequence length extends to 32k or even 128k, the current pipeline parallel methods face severe bottlenecks, including high memory footprints and substantial pipeline bubbles, greatly hindering model scalability and training throughput. To enhance memory efficiency and training throughput, in this work, we introduce an efficient sequence-level one-forward-one-backward (1F1B) pipeline scheduling method tailored for training LLMs on long sequences named Seq1F1B. Seq1F1B decomposes batch-level schedulable units into finer sequence-level units, reducing bubble size and memory footprint. Considering that Seq1F1B may produce slight extra bubbles if sequences are split evenly, we design a computation-wise strategy to partition input sequences and mitigate this side effect. Compared to competitive pipeline baseline methods such as Megatron 1F1B pipeline parallelism, our method achieves higher training throughput with less memory footprint. Notably, Seq1F1B efficiently trains a LLM with 30B parameters on sequences up to 64k using 64 NVIDIA A100 GPUs without recomputation strategies, a feat unachievable with existing methods. Our source code is based on Megatron-LM, and now is avaiable at: https://github.com/MayDomine/Seq1F1B.git.

cs.DC↗