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Junliang Lyu, Yixuan Zhang 0006, Xiaoling Lu, Feng Zhou 0011

This work addresses a key limitation in current federated learning approaches, which predominantly focus on homogeneous tasks, neglecting the task diversity on local devices. We propose a principled integration of multi-task learning using multi-output Gaussian processes (MOGP) at the local level and federated learning at the global level. MOGP handles correlated classification and regression tasks, offering a Bayesian non-parametric approach that naturally quantifies uncertainty. The central server aggregates the posteriors from local devices, updating a global MOGP prior redistributed for training local models until convergence. Challenges in performing posterior inference on local devices are addressed through the Polya-Gamma augmentation technique and mean-field variational inference, enhancing computational efficiency and convergence rate. Experimental results on both synthetic and real data demonstrate superior predictive performance, OOD detection, uncertainty calibration and convergence rate, highlighting the method's potential in diverse applications. Our code is publicly available at https://github.com/JunliangLv/task_diversity_BFL.

Zheqi Lv, Tianyu Zhan, Wenjie Wang 0007, Xinyu Lin 0001, Shengyu Zhang 0001, Wenqiao Zhang, Jiwei Li 0001, Kun Kuang 0001, Fei Wu 0001

Large Language Models (LLMs) for Recommendation (LLM4Rec) is a promising research direction that has demonstrated exceptional performance in this field. However, its inability to capture real-time user preferences greatly limits the practical application of LLM4Rec because (i) LLMs are costly to train and infer frequently, and (ii) LLMs struggle to access real-time data (its large number of parameters poses an obstacle to deployment on devices). Fortunately, small recommendation models (SRMs) can effectively supplement these shortcomings of LLM4Rec diagrams by consuming minimal resources for frequent training and inference, and by conveniently accessing real-time data on devices. In light of this, we designed the Device-Cloud LLM-SRM Collaborative Recommendation Framework (LSC4Rec) under a device-cloud collaboration setting. LSC4Rec aims to integrate the advantages of both LLMs and SRMs, as well as the benefits of cloud and edge computing, achieving a complementary synergy. We enhance the practicability of LSC4Rec by designing three strategies: collaborative training, collaborative inference, and intelligent request. During training, LLM generates candidate lists to enhance the ranking ability of SRM in collaborative scenarios and enables SRM to update adaptively to capture real-time user interests. During inference, LLM and SRM are deployed on the cloud and on the device, respectively. LLM generates candidate lists and initial ranking results based on user behavior, and SRM get reranking results based on the candidate list, with final results integrating both LLM's and SRM's scores. The device determines whether a new candidate list is needed by comparing the consistency of the LLM's and SRM's sorted lists. Our comprehensive and extensive experimental analysis validates the effectiveness of each strategy in LSC4Rec.

Zihan Luo 0001, Hong Huang 0001, Jianxun Lian, Xiran Song, Hai Jin 0001

Graph Neural Networks (GNNs) have shown remarkable capabilities in mining graph-structured data. However, conventional GNNs often encounter various fairness issues, such as predictions with prejudices when dealing with nodes with different sensitive attributes like genders or races, or significantly different prediction performance when facing nodes with different degrees. Existing studies mainly focus on addressing one specific fairness issue, neglecting the fact that a GNN model may face multiple unfairness simultaneously in reality, and addressing only one specific fairness may still leave the GNNs in an unfair status. In this paper, we focus on achieving multiple fairness on GNNs simultaneously, which we call hybrid fairness. To achieve this objective, we propose a novel GNN framework called LibraGNN. Specifically, we adopt a multi-teacher knowledge distillation training framework that successfully unifies the learning paradigms for multiple fairness. To ensure LibraGNN strikes a better trade-off among different fairness, we transform the multi-teacher knowledge distillation into a multi-objective optimization problem and further employ Pareto efficiency for optimization guidance. Finally, a controllable preference vector is introduced to assist LibraGNN in modulating its capability towards various forms of fairness, thereby achieving controllable hybrid fairness. Extensive experiments on three real-world datasets demonstrate the effectiveness of LibraGNN on both hybrid fairness and utility.

Zhiwen Luo, Wentao Fan 0001, Manar Amayri, Nizar Bouguila

Clustering high-dimensional directional data (i.e., L2 normalized vectors) presents significant challenges due to the intricate spherical representations of latent embeddings and the limitations of classical (non-deep) clustering techniques. Moreover, dynamically inferring the number of clusters remains a fundamental issue in existing deep clustering methods, especially those involving complex model-selection criteria. This paper addresses these challenges by introducing a novel deep nonparametric clustering framework that employs hyperspherical latent embeddings within a Variational Autoencoder architecture, enhanced by an infinite Von Mises-Fisher Mixture Model as a dynamic prior. This approach enables automatic adaptation of cluster numbers during training, eliminating the need for predefined clusters and traditional model selection processes. Our scalable architecture effectively integrates In-vMFMM with hyperspherical embeddings to tackle the complexities of directional data. Utilizing a joint training strategy, our method alternates between updating neural network parameters and adjusting mixture model priors via nonparametric variational Bayes. Empirical evaluations on benchmark datasets, including complex ImageNet-50, demonstrate that our approach significantly outperforms state-of-the-art deep nonparametric clustering methods. It also robustly estimates the number of clusters, showcasing its effectiveness and versatility in handling high-dimensional directional data.

Yunze Luo, Yuezihan Jiang, Yinjie Jiang, Gaode Chen, Jingchi Wang, Kaigui Bian, Peiyi Li 0008, Qi Zhang 0010

With the rise of e-commerce and short videos, online recommender systems that can capture users' interests and update new items in real-time play an increasingly important role. In both online and offline recommendation systems, the cold-start problem caused by interaction sparsity has been impacting the effectiveness of recommendations for cold-start items. Many cold-start scheme based on fine-tuning or knowledge transferring shows excellent performance on offline recommendation. Yet, these schemes are infeasible for online recommendation on streaming data pipelines due to different training method, computational overhead and time constraints. Inspired by the above questions, we propose a model-agnostic recommendation algorithm called Popularity-Aware Meta-learning (PAM), to address the item cold-start problem under streaming data settings. PAM divides the incoming data into different meta-learning tasks by predefined item popularity thresholds. The model can distinguish and reweight behavior-related and content-related features in each task based on their different roles in different popularity levels, thus adapting to recommendations for cold-start samples. These task-fixing design significantly reduces additional computation and storage costs compared to offline methods. Furthermore, PAM also introduced data augmentation and an additional self-supervised loss specifically designed for low-popularity tasks, leveraging insights from high-popularity samples. This approach effectively mitigates the issue of inadequate supervision due to the scarcity of cold-start samples. Experimental results across multiple public datasets demonstrate the superiority of our approach over other baseline methods in addressing cold-start challenges in online streaming data scenarios.

Yingtao Luo, Zhixun Li, Qiang Liu 0006, Jun Zhu 0001

Machine learning systems are notoriously prone to biased predictions about certain demographic groups, leading to algorithmic fairness issues. Due to privacy concerns and data quality problems, some demographic information may not be available in the training data and the complex interaction of different demographics can lead to a lot of unknown minority subpopulations, which all limit the applicability of group fairness. Many existing works on fairness without demographics assume the correlation between groups and features. However, we argue that the model gradients are also valuable for fairness without demographics. In this paper, we show that the correlation between gradients and groups can help identify and improve group fairness. With an adversarial weighting architecture, we construct a graph where samples with similar gradients are connected and learn the weights of different samples from it. Unlike the surrogate grouping methods that cluster groups from features and labels as proxy sensitive attribute, our method leverages the graph structure as a soft grouping mechanism, which is much more robust to noises. The results show that our method is robust to noise and can improve fairness significantly without decreasing the overall accuracy too much.

Xiao Luo 0001, Junyu Luo 0002, Huiyu Jiang, Hang Zhou 0008, Zhiping Xiao 0001, Wei Ju 0001, Carl Ji Yang, Ming Zhang 0004, Yizhou Sun

This paper investigates the problem of learning mesh-based physical simulations, which is a crucial task with applications in fluid mechanics and aerodynamics. Recent works typically utilize graph neural networks (GNNs) to produce next-time states on irregular meshes by modeling interacting dynamics, and then adopt iterative rollouts for the whole trajectories. However, these methods cannot achieve satisfactory performance in long-term predictions due to the failure of capturing long-term dependency and potential error accumulations. To tackle this, we introduce a new future-to-present learning perspective, and further develop a simple yet effective approach named Foresight And Interpolation (FAIR) for long-term mesh-based simulations. The main idea of our FAIR is to first learn a graph ODE model for coarse long-term predictions and then refine short-term predictions via interpolation. Specifically, FAIR employs a continuous graph ODE model that incorporates past states into the evolution of interacting node representations, which is capable of learning coarse long-term trajectories under a multi-task learning framework. Then, we leverage a channel aggregation strategy to summarize the trajectories for refined short-term predictions, which can be illustrated using an interpolation process. Through pyramid-like alternative propagation between the foresight step and refinement step, our proposed framework FAIR can generate accurate long-term trajectories, achieving a significant error reduction compared with the best baseline on four benchmark datasets. Extensive ablation studies and visualization further validate the superiority of our proposed FAIR.

Yuxuan Liu 0009, Hongda Sun 0001, Wei Liu 0302, Jian Luan 0001, Bo Du 0001, Rui Yan 0001

Mobile phone agents can assist people in automating daily tasks on their phones, which have emerged as a pivotal research spotlight. However, existing procedure-oriented agents struggle with cross-app instructions, due to the following challenges: (1) complex task relationships, (2) diverse app environment, and (3) error propagation and information loss in multi-step execution. Drawing inspiration from object-oriented programming principles, we recognize that object-oriented solutions is more suitable for cross-app instruction. To address these challenges, we propose a self-evolving multi-agent framework named MobileSteward which integrates multiple app-oriented StaffAgents coordinated by a centralized StewardAgent. We design three specialized modules in MobileSteward: (1) Dynamic Recruitment generates a scheduling graph guided by information flow to explicitly associate tasks among apps. (2) Assigned Execution assigns the task to app-oriented StaffAgents, each equipped with app-specialized expertise to address the diversity between apps. (3) Adjusted Evaluation conducts evaluation to provide reflection tips or deliver key information, which alleviates error propagation and information loss during multi-step execution. To continuously improve the performance of MobileSteward, we develop a Memory-based Self-evolution mechanism, which summarizes the experience from successful execution, to improve the performance of MobileSteward. We establish the first English Cross-APP Benchmark (CAPBench) in the real-world environment to evaluate the agents' capabilities of solving complex cross-app instructions. Experimental results demonstrate that MobileSteward achieves the best performance compared to both single-agent and multi-agent frameworks, highlighting the superiority of MobileSteward in better handling user instructions with diverse complexity.

Yonghao Liu 0001, Fausto Giunchiglia, Ximing Li 0002, Lan Huang 0002, Xiaoyue Feng, Renchu Guan

Graph few-shot learning has garnered significant attention for its ability to rapidly adapt to downstream tasks with limited labeled data, sparking considerable interest among researchers. Recent advancements in graph few-shot learning models have exhibited superior performance across diverse applications. Despite their successes, several limitations still exist. First, existing models in the meta-training phase predominantly focus on instance-level features within tasks, neglecting crucial set-level features essential for distinguishing between different categories. Second, these models often utilize query sets directly on classifiers trained with support sets containing only a few labeled examples, overlooking potential distribution shifts between these sets and leading to suboptimal performance. Finally, previous models typically require necessitate abundant labeled data from base classes to extract transferable knowledge, which is typically infeasible in real-world scenarios. To address these issues, we propose a novel model named STAR, which leverages Set funcTions and optimAl tRansport for enhancing unsupervised graph few-shot learning. Specifically, STAR utilizes expressive set functions to obtain set-level features in an unsupervised manner and employs optimal transport principles to align the distributions of support and query sets, thereby mitigating distribution shift effects. Theoretical analysis demonstrates that STAR can capture more task-relevant information and enhance generalization capabilities. Empirically, extensive experiments across multiple datasets validate the effectiveness of STAR. Our code can be found https://github.com/KEAML-JLU/STAR here.

Xufeng Liu 0002, Dongsheng Luo, Wenhan Gao 0002, Yi Liu 0059

We consider the explanation of 3D graph neural networks (GNNs) in the field of molecular learning. Recent studies have modeled molecules as 3D graphs, but there exist formidable challenges for 3D graph explanation. In this work, we propose a novel and principled paradigm, known as 3DGraphX, for 3D molecular graph explanation. Unlike existing 2D GNN explanation methods, 3DGraphX focuses on 3D motifs, which are subgraphs showing great occurrence and function significance in molecular activities. Once generated, 3D motifs are fixed in the explanation model; hence, 3DGraphX produces more accurate and chemically plausible explanations in an efficient manner. 3DGraphX contains two branches with several novel methods for instance-level and geometry-level explanations, respectively. Two novel components, known as the mask pooling component and mask unpooling component, are developed to discover important motifs for each 3D molecule as the instance-level explanation. Local spherical coordinate systems are built to investigate the relative positions among motifs for geometry-level explanation. Altogether, 3DGraphX sheds light on the characteristics of molecules as well as the behaviors of 3D GNNs in molecular learning. Experimental results show that 3DGraphX significantly outperforms baselines in instance-level explanation with various explanation budgets. Additional experiments show that 3DGraphX reveals the important geometries taken by 3D GNNs for accurate molecular learning. The code is publicly available at https://github.com/xufliu/3DGraphX.

Xiaohao Liu, Jie Wu, Zhulin Tao, Yunshan Ma 0002, Yinwei Wei, Tat-Seng Chua

Recent advances in product bundling have leveraged multimodal information through sophisticated encoders, but remain constrained by limited semantic understanding and a narrow scope of knowledge. Therefore, some attempts employ In-context Learning (ICL) to explore the potential of large language models (LLMs) for their extensive knowledge and complex reasoning abilities. However, these efforts are inadequate in understanding mulitmodal data and exploiting LLMs' knowledge for product bundling. To bridge the gap, we introduce Bundle-MLLM, a novel framework that fine-tunes LLMs through a hybrid item tokenization approach within a well-designed optimization strategy. Specifically, we integrate textual, media, and relational data into a unified tokenization, introducing a soft separation token to distinguish between textual and non-textual tokens. Additionally, a streamlined yet powerful multimodal fusion module is employed to embed all non-textual features into a single, informative token, significantly boosting efficiency. To tailor product bundling tasks for LLMs, we reformulate the task as a multiple-choice question with candidate items as options. We further propose a progressive optimization strategy that fine-tunes LLMs for disentangled objectives: learning bundle patterns and enhancing multimodal semantic understanding specific to product bundling. Extensive experiments demonstrate that our approach outperforms a range of state-of-the-art (SOTA) methods. Codes are available at https://github.com/Xiaohao-Liu/Bundle-MLLM

Shuo Liu 0017, Zihan Zhou, Yuanhao Liu, Jing Zhang 0148, Hong Qian

Cognitive diagnosis aims to infer students' mastery levels based on their historical response logs. However, existing cognitive diagnosis models (CDMs), which rely on ID embeddings, often have to train specific models on specific domains. This limitation may hinder their directly practical application in various target domains, such as different subjects (e.g., Math, English and Physics) or different education platforms (e.g., ASSISTments, Junyi Academy and Khan Academy). To address this issue, this paper proposes the language representation favored zero-shot cross-domain cognitive diagnosis (LRCD). Specifically, LRCD first analyzes the behavior patterns of students, exercises and concepts in different domains, and then describes the profiles of students, exercises and concepts using textual descriptions. Via recent advanced text-embedding modules, these profiles can be transformed to vectors in the unified language space. Moreover, to address the discrepancy between the language space and the cognitive diagnosis space, we propose language-cognitive mappers in LRCD to learn the mapping from the former to the latter. Then, these profiles can be easily and efficiently integrated and trained with existing CDMs. Extensive experiments show that training LRCD on real-world datasets can achieve commendable zero-shot performance across different target domains, and in some cases, it can even achieve competitive performance with some classic CDMs trained on the full response data on target domains. Notably, we surprisingly find that LRCD can also provide interesting insights into the differences between various subjects (such as humanities and sciences) and sources (such as primary and secondary education).

Qu Liu, Emil Zulawnik, Tingjian Ge

Dynamic graphs are common in many applications to conveniently model heterogeneous data integrated from multiple sources. We study the monitoring of predictive events in dynamic graphs. Treating the problem as a continuous multi-label classification, we use deep metric learning to manage the embedding space and to create spherical codes where each codeword is an embedding vector representing a cluster of data state embeddings with the same results of the predictive events. By continuously training data embeddings from a dynamic graph neural network (DGNN) model and a code generator together, our method, called SCode, achieves significantly better accuracy than DGNN baselines. Moreover, SCode is also about twice as fast as the DGNN baselines, owing to its efficient matching between data state embedding and codewords for multiple events together. Finally, our training sample complexity analysis also sheds light on the generalizability of the online learning.

Han Liu 0008, Haotian Gao, Xiaotong Zhang 0003, Changya Li, Feng Zhang 0027, Wei Wang 0077, Fenglong Ma, Hong Yu 0005

Large language models (LLMs) have shown remarkable performance in various domains, but they are constrained by massive computational and storage costs. Quantization, an effective technique for compressing models to fit resource-limited devices while preserving generative quality, encompasses two primary methods: quantization aware training (QAT) and post-training quantization (PTQ). QAT involves additional retraining or fine-tuning, thus inevitably resulting in high training cost and making it unsuitable for LLMs. Consequently, PTQ has become the research hotspot in recent quantization methods. However, existing PTQ methods usually rely on various complex computation procedures and suffer from considerable performance degradation under low-bit quantization settings. To alleviate the above issues, we propose a simple and effective post-training quantization paradigm for LLMs, named SEPTQ. Specifically, SEPTQ first calculates the importance score for each element in the weight matrix and determines the quantization locations in a static global manner. Then it utilizes the mask matrix which represents the important locations to quantize and update the associated weights column-by-column until the appropriate quantized weight matrix is obtained. Compared with previous methods, SEPTQ simplifies the post-training quantization procedure into only two steps, and considers the effectiveness and efficiency simultaneously. Experimental results on various datasets across a suite of models ranging from millions to billions in different quantization bit-levels demonstrate that SEPTQ significantly outperforms other strong baselines, especially in low-bit quantization scenarios.

Gang Liu 0025, Fan Yang 0084, Yang Jiao, Alireza Bagheri Garakani, Tian Tong, Yan Gao 0029, Meng Jiang 0001

The data on user behaviors is sparse given the vast array of user-item combinations. Attributes related to users (e.g., age), items (e.g., brand), and behaviors (e.g., co-purchase) serve as crucial input sources for item-item transitions of user's behavior prediction. While recent Transformer-based sequential recommender systems learn the attention matrix for each attribute to update item representations, the attention of a specific attribute is optimized by gradients from all input sources, leading to potential information mixture. Besides, Transformers mainly focus on intra-sequence attention for item attributes, neglecting cross-sequence relations and user attributes. Addressing these challenges, we propose the Attribute Transformer (AttrFormer) to learn attributes as explicit relations. This model transforms each type of attribute into an explicit relation defined in the feature space, and it ensures no information mixing among different input sources. Explicit relations introduce cross-sequence and intra-sequence relations. AttrFormer has novel relation-augmented heads to handle them at both the item and behavioral levels, seamlessly integrating the augmented heads into the multi-head attention mechanism. Furthermore, we employ position-to-position aggregation to refine behavior representation for users with similar patterns at the sequence level. To capture the subjective nature of user preferences, AttrFormer is trained using posterior targets where upcoming user behaviors follow a multinomial distribution with a Dirichlet prior. Our evaluations on four popular datasets, including Amazon (Toys & Games and Beauty) and MovieLens (1M and 25M versions), reveal that AttrFormer outperforms leading Transformer baselines, achieving around 20% improvement in NDCG@20 scores. Extensive ablation studies also demonstrate the efficiency of AttrFormer in managing long behavior sequences and inter-sequence relations.

Xiaoyang Lin, Renchi Yang, Haoran Zheng, Xiangyu Ke

Subspace clustering seeks to identify subspaces that segment a set of n data points into k (k« n) groups, which has emerged as a powerful tool for analyzing data from various domains, especially images and videos. Recently, several studies have demonstrated the great potential of subspace clustering models for partitioning vertices in attributed graphs, referred to as SCAG. However, these works either demand significant computational overhead for constructing the nxn self-expressive matrix, or fail to incorporate graph topology and attribute data into the subspace clustering framework effectively, and thus, compromise result quality. Motivated by this, this paper presents two effective and efficient algorithms, S2CAG M-S2CAG for SCAG computation. Particularly, S2CAG obtains superb performance through three major contributions. First, we formulate a new objective function for SCAG with a refined representation model for vertices and two non-trivial constraints. On top of that, an efficient linear-time optimization solver is developed based on our theoretically grounded problem transformation and well-thought-out adaptive strategy. We then conduct an in-depth analysis to disclose the theoretical connection of S2CAG to conductance minimization, which further inspires the design of M-S2CAG that maximizes the modularity. Our extensive experiments, comparing S2CAG and M-S2CAG against 17 competitors over 8 benchmark datasets, exhibit that our solutions outperform all baselines in terms of clustering quality measured against the ground truth while delivering high efficiency.

Minhua Lin, Enyan Dai, Junjie Xu, Jinyuan Jia 0001, Xiang Zhang 0001, Suhang Wang

Graph Neural Networks (GNNs) have shown promising results in modeling graphs in various tasks. The training of GNNs, especially on specialized tasks such as bioinformatics, demands extensive expert annotations, which are expensive and usually contain sensitive information of data providers. The trained GNN models are often shared for deployment in the real world. As neural networks can memorize the training samples, the model parameters of GNNs have a high risk of leaking private training data. Our theoretical analysis shows the strong connections between trained GNN parameters and the training graphs used, confirming the training graph leakage issue. However, explorations into training data leakage from trained GNNs are rather limited. Therefore, we investigate a novel problem of stealing graphs from trained GNNs. To obtain high-quality graphs that resemble the target training set, a graph diffusion model with diffusion noise optimization is deployed as a graph generator. Furthermore, we propose a selection method that effectively leverages GNN model parameters to identify training graphs from samples generated by the graph diffusion model. Extensive experiments on real-world datasets demonstrate the effectiveness of the proposed framework in stealing training graphs from the trained GNN.

Weibin Liao, Yinghao Zhu, Zhongji Zhang, Yuhang Wang 0031, Zixiang Wang, Xu Chu, Yasha Wang, Liantao Ma

Analyzing the health status of patients based on Electronic Health Records (EHR) is a fundamental research problem in medical informatics. The presence of extensive missing values in EHR makes it challenging for deep neural networks (DNNs) to directly model the patient's health status. Existing DNNs training protocols, including Impute-then-Regress Procedure and Jointly Optimizing of Impute-n-Regress Procedure, require the additional imputation models to reconstruction missing values. However, Impute-then-Regress Procedure introduces the risk of injecting imputed, non-real data into downstream clinical prediction tasks, resulting in power loss, biased estimation, and poorly performing models, while Jointly Optimizing of Impute-n-Regress Procedure is also difficult to generalize due to the complex optimization space and demanding data requirements. Inspired by the recent advanced literature of learnable prompt in the fields of NLP and CV, in this work, we rethought the necessity of the imputation model in downstream clinical tasks, and proposed Learnable Prompt as Pseudo-Imputation (PAI) as a new training protocol to assist EHR analysis. PAI no longer introduces any imputed data but constructs a learnable prompt to model the implicit preferences of the downstream model for missing values, resulting in a significant performance improvement for all state-of-the-arts EHR analysis models on four real-world datasets across two clinical prediction tasks. Further experimental analysis indicates that PAI exhibits higher robustness in situations of data insufficiency and high missing rates. More importantly, as a plug-and-play protocol, PAI can be easily integrated into any existing or even imperceptible future EHR analysis models. The code of this work is deployed publicly available at https://github.com/MrBlankness/PAI to help the research community reproduce the results and assist the EHR analysis tasks.

Daojun Liang

Traditional regression and prediction tasks often only provide deterministic point estimates. To estimate the distribution or uncertainty of the response variable, traditional methods either assume that the posterior distribution of samples follows a Gaussian process or require thousands of forward passes for sample generation. We propose a novel approach called DistPred for regression and forecasting tasks, which overcomes the limitations of existing methods while remaining simple and powerful. Specifically, we transform proper scoring rules that measure the discrepancy between the predicted distribution and the target distribution into a differentiable discrete form and use it as a loss function to train the model end-to-end. This allows the model to sample numerous samples in a single forward pass to estimate the potential distribution of the response variable. We have compared our method with several existing approaches on multiple datasets and achieved state-of-the-art performance. Additionally, our method significantly improves computational efficiency. For example, compared to state-of-the-art models, DistPred has a 180x faster inference speed.