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Knowledge graphs in heterogeneous catalysis: Recent advances and future opportunities
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作者 Raúl Díaz Hongliang Xin 《Chinese Journal of Chemical Engineering》 2025年第8期179-189,共11页
Knowledge graphs (KGs) offer a structured, machine-readable format for organizing complex information. In heterogeneous catalysis, where data on catalytic materials, reaction conditions, mechanisms, and synthesis rout... Knowledge graphs (KGs) offer a structured, machine-readable format for organizing complex information. In heterogeneous catalysis, where data on catalytic materials, reaction conditions, mechanisms, and synthesis routes are dispersed across diverse sources, KGs provide a semantic framework that supports data integration under the FAIR (Findable, Accessible, Interoperable, and Reusable) principles. This review aims to survey recent developments in catalysis KGs, describe the main techniques for graph construction, and highlight how artificial intelligence, particularly large language models (LLMs), enhances graph generation and query. We conducted a systematic analysis of the literature, focusing on ontology-guided text mining pipelines, graph population methods, and maintenance strategies. Our review identifies key trends: ontology-based approaches enable the automated extraction of domain knowledge, LLM-driven retrieval-augmented generation supports natural-language queries, and scalable graph architectures range from a few thousand to over a million triples. We discuss state-of-the-art applications, such as catalyst recommendation systems and reaction mechanism discovery tools, and examine the major challenges, including data heterogeneity, ontology alignment, and long-term graph curation. We conclude that KGs, when combined with AI methods, hold significant promise for accelerating catalyst discovery and knowledge management, but progress depends on establishing community standards for ontology development and maintenance. This review provides a roadmap for researchers seeking to leverage KGs to advance heterogeneous catalysis research. 展开更多
关键词 heterogeneous catalysis Knowledge graph ONTOLOGY Large language models Deep learning
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DHGT-DTI:Advancing drug-target interaction prediction through a dual-view heterogeneous network with GraphSAGE and Graph Transformer
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作者 Mengdi Wang Xiujuan Lei +2 位作者 Ling Guo Ming Chen Yi Pan 《Journal of Pharmaceutical Analysis》 2025年第10期2442-2456,共15页
Computational approaches for predicting drug-target interactions(DTIs)are pivotal in advancing drug discovery.Current methodologies leveraging heterogeneous networks often fall short in fully integrating both local an... Computational approaches for predicting drug-target interactions(DTIs)are pivotal in advancing drug discovery.Current methodologies leveraging heterogeneous networks often fall short in fully integrating both local and global network information.To comprehensively consider network information,we propose DHGT-DTI,a novel deep learning-based approach for DTI prediction.Specifically,we capture the local and global structural information of the network from both neighborhood and meta-path per-spectives.In the neighborhood perspective,we employ a heterogeneous graph neural network(HGNN),which extends Graph Sample and Aggregate(GraphSAGE)to handle diverse node and edge types,effectively learning local network structures.In the meta-path perspective,we introduce a Graph Transformer with residual connections to model higher-order relationships defined by meta-paths,such as"drug-disease-drug",and use an attention mechanism to fuse information across multiple meta-paths.The learned features from these dual perspectives are synergistically integrated for DTI prediction via a matrix decomposition method.Furthermore,DHGT-DTI reconstructs not only the DTI network but also auxiliary networks to bolster prediction accuracy.Comprehensive experiments on two benchmark datasets validate the superiority of DHGT-DTI over existing baseline methods.Additionally,case studies on six drugs used to treat Parkinson's disease not only validate the practical utility of DHGT-DTI but also highlight its broader potential in accelerating drug discovery for other diseases. 展开更多
关键词 Drug-target interaction(DTI) graph Transformer graph sample and aggregate(graphSAGE) heterogeneous network
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A novel modeling approach for vertical handover based on dynamic k-partite graph in heterogeneous networks 被引量:3
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作者 Mohamed Lahby Ayoub Essouiri Abderrahim Sekkaki 《Digital Communications and Networks》 SCIE 2019年第4期297-307,共11页
The future network world will be embedded with different generations of wireless technologies,such as 3G,4G and 5G.At the same time,the development of new devices equipped with multiple interfaces is growing rapidly i... The future network world will be embedded with different generations of wireless technologies,such as 3G,4G and 5G.At the same time,the development of new devices equipped with multiple interfaces is growing rapidly in recent years.As a consequence,the vertical handover protocol is developed in order to provide ubiquitous connectivity in the heterogeneous wireless environment.Indeed,by using this protocol,the users have opportunities to be connected to the Internet through a variety of wireless technologies at any time and anywhere.The main challenge of this protocol is how to select the best access network in terms of Quality of Service(QoS)for users.For that,many algorithms have been proposed and developed to deal with the issue in recent studies.However,all existing algorithms permit only the selection of one access network from the available networks during the vertical handover process.To cope with this problem,in this paper we propose a new approach based on k-partite graph.Firstly,we introduce k-partite graph theory to model the vertical handover problem.Secondly,the selection of the best path is performed by a robust and lightweight mechanism based on cost function and Dijkstra’s algorithm.The experimental results show that the proposed approach can achieve better performance of QoS than the existing algorithms for FTP traffic and video streaming. 展开更多
关键词 heterogeneous wireless networks Vertical handover K-partite graph Cost function QOS Mininet
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Attack Behavior Extraction Based on Heterogeneous Cyberthreat Intelligence and Graph Convolutional Networks 被引量:1
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作者 Binhui Tang Junfeng Wang +3 位作者 Huanran Qiu Jian Yu Zhongkun Yu Shijia Liu 《Computers, Materials & Continua》 SCIE EI 2023年第1期235-252,共18页
The continuous improvement of the cyber threat intelligence sharing mechanism provides new ideas to deal with Advanced Persistent Threats(APT).Extracting attack behaviors,i.e.,Tactics,Techniques,Procedures(TTP)from Cy... The continuous improvement of the cyber threat intelligence sharing mechanism provides new ideas to deal with Advanced Persistent Threats(APT).Extracting attack behaviors,i.e.,Tactics,Techniques,Procedures(TTP)from Cyber Threat Intelligence(CTI)can facilitate APT actors’profiling for an immediate response.However,it is difficult for traditional manual methods to analyze attack behaviors from cyber threat intelligence due to its heterogeneous nature.Based on the Adversarial Tactics,Techniques and Common Knowledge(ATT&CK)of threat behavior description,this paper proposes a threat behavioral knowledge extraction framework that integrates Heterogeneous Text Network(HTN)and Graph Convolutional Network(GCN)to solve this issue.It leverages the hierarchical correlation relationships of attack techniques and tactics in the ATT&CK to construct a text network of heterogeneous cyber threat intelligence.With the help of the Bidirectional EncoderRepresentation fromTransformers(BERT)pretraining model to analyze the contextual semantics of cyber threat intelligence,the task of threat behavior identification is transformed into a text classification task,which automatically extracts attack behavior in CTI,then identifies the malware and advanced threat actors.The experimental results show that F1 achieve 94.86%and 92.15%for the multi-label classification tasks of tactics and techniques.Extend the experiment to verify the method’s effectiveness in identifying the malware and threat actors in APT attacks.The F1 for malware and advanced threat actors identification task reached 98.45%and 99.48%,which are better than the benchmark model in the experiment and achieve state of the art.The model can effectivelymodel threat intelligence text data and acquire knowledge and experience migration by correlating implied features with a priori knowledge to compensate for insufficient sample data and improve the classification performance and recognition ability of threat behavior in text. 展开更多
关键词 Attack behavior extraction cyber threat intelligence(CTI) graph convolutional network(GCN) heterogeneous textual network(HTN)
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Heterogeneous graph construction and node representation learning method of Treatise on Febrile Diseases based on graph convolutional network 被引量:1
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作者 YAN Junfeng WEN Zhihua ZOU Beiji 《Digital Chinese Medicine》 2022年第4期419-428,共10页
Objective To construct symptom-formula-herb heterogeneous graphs structured Treatise on Febrile Diseases(Shang Han Lun,《伤寒论》)dataset and explore an optimal learning method represented with node attributes based o... Objective To construct symptom-formula-herb heterogeneous graphs structured Treatise on Febrile Diseases(Shang Han Lun,《伤寒论》)dataset and explore an optimal learning method represented with node attributes based on graph convolutional network(GCN).Methods Clauses that contain symptoms,formulas,and herbs were abstracted from Treatise on Febrile Diseases to construct symptom-formula-herb heterogeneous graphs,which were used to propose a node representation learning method based on GCN−the Traditional Chinese Medicine Graph Convolution Network(TCM-GCN).The symptom-formula,symptom-herb,and formula-herb heterogeneous graphs were processed with the TCM-GCN to realize high-order propagating message passing and neighbor aggregation to obtain new node representation attributes,and thus acquiring the nodes’sum-aggregations of symptoms,formulas,and herbs to lay a foundation for the downstream tasks of the prediction models.Results Comparisons among the node representations with multi-hot encoding,non-fusion encoding,and fusion encoding showed that the Precision@10,Recall@10,and F1-score@10 of the fusion encoding were 9.77%,6.65%,and 8.30%,respectively,higher than those of the non-fusion encoding in the prediction studies of the model.Conclusion Node representations by fusion encoding achieved comparatively ideal results,indicating the TCM-GCN is effective in realizing node-level representations of heterogeneous graph structured Treatise on Febrile Diseases dataset and is able to elevate the performance of the downstream tasks of the diagnosis model. 展开更多
关键词 graph convolutional network(GCN) heterogeneous graph Treatise on Febrile Diseases(Shang Han Lun 《伤寒论》) Node representations on heterogeneous graph Node representation learning
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A Software Defect Prediction Method Using a Multivariate Heterogeneous Hybrid Deep Learning Algorithm
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作者 Qi Fei Haojun Hu +1 位作者 Guisheng Yin Zhian Sun 《Computers, Materials & Continua》 2025年第2期3251-3279,共29页
Software defect prediction plays a critical role in software development and quality assurance processes. Effective defect prediction enables testers to accurately prioritize testing efforts and enhance defect detecti... Software defect prediction plays a critical role in software development and quality assurance processes. Effective defect prediction enables testers to accurately prioritize testing efforts and enhance defect detection efficiency. Additionally, this technology provides developers with a means to quickly identify errors, thereby improving software robustness and overall quality. However, current research in software defect prediction often faces challenges, such as relying on a single data source or failing to adequately account for the characteristics of multiple coexisting data sources. This approach may overlook the differences and potential value of various data sources, affecting the accuracy and generalization performance of prediction results. To address this issue, this study proposes a multivariate heterogeneous hybrid deep learning algorithm for defect prediction (DP-MHHDL). Initially, Abstract Syntax Tree (AST), Code Dependency Network (CDN), and code static quality metrics are extracted from source code files and used as inputs to ensure data diversity. Subsequently, for the three types of heterogeneous data, the study employs a graph convolutional network optimization model based on adjacency and spatial topologies, a Convolutional Neural Network-Bidirectional Long Short-Term Memory (CNN-BiLSTM) hybrid neural network model, and a TabNet model to extract data features. These features are then concatenated and processed through a fully connected neural network for defect prediction. Finally, the proposed framework is evaluated using ten promise defect repository projects, and performance is assessed with three metrics: F1, Area under the curve (AUC), and Matthews correlation coefficient (MCC). The experimental results demonstrate that the proposed algorithm outperforms existing methods, offering a novel solution for software defect prediction. 展开更多
关键词 Software defect prediction multiple heterogeneous data graph convolutional network models based on adjacency and spatial topologies CNN-BiLSTM TabNet
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Output Consensus of Heterogeneous Linear MASs via Adaptive Event-Triggered Feedback Combination Control
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作者 Shuo Yuan Chengpu Yu Jian Sun 《IEEE/CAA Journal of Automatica Sinica》 2025年第1期285-287,共3页
Dear Editor,This letter studies output consensus problem of heterogeneous linear multiagent systems over directed graphs. A novel adaptive dynamic event-triggered controller is presented based only on the feedback com... Dear Editor,This letter studies output consensus problem of heterogeneous linear multiagent systems over directed graphs. A novel adaptive dynamic event-triggered controller is presented based only on the feedback combination of the agent's own state and neighbors' output,which can achieve exponential output consensus through intermittent communication. The controller is obtained by solving two linear matrix equations, and Zeno behavior is excluded. 展开更多
关键词 intermittent communication feedback combination heterogeneous linear multiagent systems exponential output consensus directed graphs output consensus problem output consensus solving two linear matrix equations
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Topic-Aware Abstractive Summarization Based on Heterogeneous Graph Attention Networks for Chinese Complaint Reports
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作者 Yan Li Xiaoguang Zhang +4 位作者 Tianyu Gong Qi Dong Hailong Zhu Tianqiang Zhang Yanji Jiang 《Computers, Materials & Continua》 SCIE EI 2023年第9期3691-3705,共15页
Automatic text summarization(ATS)plays a significant role in Natural Language Processing(NLP).Abstractive summarization produces summaries by identifying and compressing the most important information in a document.Ho... Automatic text summarization(ATS)plays a significant role in Natural Language Processing(NLP).Abstractive summarization produces summaries by identifying and compressing the most important information in a document.However,there are only relatively several comprehensively evaluated abstractive summarization models that work well for specific types of reports due to their unstructured and oral language text characteristics.In particular,Chinese complaint reports,generated by urban complainers and collected by government employees,describe existing resident problems in daily life.Meanwhile,the reflected problems are required to respond speedily.Therefore,automatic summarization tasks for these reports have been developed.However,similar to traditional summarization models,the generated summaries still exist problems of informativeness and conciseness.To address these issues and generate suitably informative and less redundant summaries,a topic-based abstractive summarization method is proposed to obtain global and local features.Additionally,a heterogeneous graph of the original document is constructed using word-level and topic-level features.Experiments and analyses on public review datasets(Yelp and Amazon)and our constructed dataset(Chinese complaint reports)show that the proposed framework effectively improves the performance of the abstractive summarization model for Chinese complaint reports. 展开更多
关键词 Text summarization TOPIC Chinese complaint report heterogeneous graph attention network
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Insider threat detection approach for tobacco industry based on heterogeneous graph embedding
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作者 季琦 LI Wei +2 位作者 PAN Bailin XUE Hongkai QIU Xiang 《High Technology Letters》 EI CAS 2024年第2期199-210,共12页
In the tobacco industry,insider employee attack is a thorny problem that is difficult to detect.To solve this issue,this paper proposes an insider threat detection method based on heterogeneous graph embedding.First,t... In the tobacco industry,insider employee attack is a thorny problem that is difficult to detect.To solve this issue,this paper proposes an insider threat detection method based on heterogeneous graph embedding.First,the interrelationships between logs are fully considered,and log entries are converted into heterogeneous graphs based on these relationships.Second,the heterogeneous graph embedding is adopted and each log entry is represented as a low-dimensional feature vector.Then,normal logs and malicious logs are classified into different clusters by clustering algorithm to identify malicious logs.Finally,the effectiveness and superiority of the method is verified through experiments on the CERT dataset.The experimental results show that this method has better performance compared to some baseline methods. 展开更多
关键词 insider threat detection advanced persistent threats graph construction heterogeneous graph embedding
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Scheduling algorithm based on critical tasks in heterogeneous environments 被引量:4
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作者 Lan Zhou Sun Shixin 《Journal of Systems Engineering and Electronics》 SCIE EI CSCD 2008年第2期398-404,F0003,共8页
Heterogeneous computing is one effective method of high performance computing with many advantages. Task scheduling is a critical issue in heterogeneous environments as well as in homogeneous environments. A number of... Heterogeneous computing is one effective method of high performance computing with many advantages. Task scheduling is a critical issue in heterogeneous environments as well as in homogeneous environments. A number of task scheduling algorithms for homogeneous environments have been proposed, whereas, a few for heterogeneous environments can be found in the literature. A novel task scheduling algorithm for heterogeneous environments, called the heterogeneous critical task (HCT) scheduling algorithm is presented. By means of the directed acyclic graph and the gantt graph, the HCT algorithm defines the critical task and the idle time slot. After determining the critical tasks of a given task, the HCT algorithm tentatively duplicates the critical tasks onto the processor that has the given task in the idle time slot, to reduce the start time of the given task. To compare the performance of the HCT algorithm with several recently proposed algorithms, a large set of randomly generated applications and the Gaussian elimination application are randomly generated. The experimental result has shown that the HCT algorithm outperforms the other algorithm. 展开更多
关键词 list scheduling task duplication task graphs heterogeneous environment parallel processing.
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A Novel Resource Allocation Algorithm based on Downlink and Uplink Decouple Access Scheme in Heterogeneous Networks 被引量:4
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作者 Laiwei Jiang Xuejun Sha +1 位作者 Xuanli Wu Naitong Zhang 《China Communications》 SCIE CSCD 2016年第6期22-31,共10页
Traditional cellular network requires that a user equipment(UE) should associate to the same base station(BS) in both the downlink(DL) and the uplink(UL). Based on dual connectivity(DC) introduced in LTE-Advanced R12,... Traditional cellular network requires that a user equipment(UE) should associate to the same base station(BS) in both the downlink(DL) and the uplink(UL). Based on dual connectivity(DC) introduced in LTE-Advanced R12, DL/UL decouple access scheme has been proposed, which is especially suitable for heterogeneous networks(Het Nets). This paper is the pioneer to take the DL/UL decouple access scheme into consideration and develop a novel resource allocation algorithm in a two-tier Het Net to improve the total system throughput in the UL and ease the load imbalance between macro base stations(MBSs) and pico base stations(PBSs). A model is formulated as a nonlinear integer programming, and the proposed algorithm is a sub-optimal algorithm based on the graph theory. First, an undirected and weighted interference graph is obtained. Next, the users are grouped to let users with large mutual interferences to be assigned to different clusters. Then, the users in different clusters are allocated to different resource blocks(RBs) by using the Hungarian algorithm. Simulation results show that the proposed algorithm can provide great promotions for both the total system throughput and the average cell edge user throughput and successfully ease the load imbalance between MBSs and PBSs. 展开更多
关键词 LTE-ADVANCED downlink and up-link decouple access scheme heterogeneous networks resource allocation graph theory
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Event Relation Extraction Based on Heterogeneous Graph Attention Networks and Event Ontology Direction Induction
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作者 Wenjie Liu Zhifan Wang 《Tsinghua Science and Technology》 2026年第1期504-517,共14页
Event relation extraction plays a crucial role in constructing an event knowledge graph.However,current models only extract trigger words as event ontology representations,and do not consider node type during informat... Event relation extraction plays a crucial role in constructing an event knowledge graph.However,current models only extract trigger words as event ontology representations,and do not consider node type during information aggregation,resulting in low accuracy in event relation extraction.To address these challenges,we propose an event relation extraction model based on heterogeneous graph attention networks and event ontology direction induction.To enhance the completeness of event information,we incorporate argument role information,in addition to trigger words,into the input text.A novel heterogeneous graph attention framework is proposed to reasonably allocate weights to trigger words,argument roles,and text information,and then perform two levels of aggregation,node-level and semantic-level,in sequence.To improve the accuracy of event direction discrimination,we construct an event ontology subgraph that includes trigger words and arguments to aggregate complete event structure information during direction induction.Finally,we evaluate our model on three datasets,TimeBank-Dense,MATRES,and HiEve,and demonstrate that our model outperforms state-of-the-art models by 1.2%,0.5%,and 0.8%,respectively,in terms of the Micro-F1 score.Our proposed model provides a promising solution for event relation extraction and can be applied in various natural language processing applications. 展开更多
关键词 event relation extraction argument role heterogeneous graph networks Event Ontology Direction Induction(EODI)
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Heterogeneous Network Embedding: A Survey
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作者 Sufen Zhao Rong Peng +1 位作者 Po Hu Liansheng Tan 《Computer Modeling in Engineering & Sciences》 SCIE EI 2023年第10期83-130,共48页
Real-world complex networks are inherently heterogeneous;they have different types of nodes,attributes,and relationships.In recent years,various methods have been proposed to automatically learn how to encode the stru... Real-world complex networks are inherently heterogeneous;they have different types of nodes,attributes,and relationships.In recent years,various methods have been proposed to automatically learn how to encode the structural and semantic information contained in heterogeneous information networks(HINs)into low-dimensional embeddings;this task is called heterogeneous network embedding(HNE).Efficient HNE techniques can benefit various HIN-based machine learning tasks such as node classification,recommender systems,and information retrieval.Here,we provide a comprehensive survey of key advancements in the area of HNE.First,we define an encoder-decoder-based HNE model taxonomy.Then,we systematically overview,compare,and summarize various state-of-the-art HNE models and analyze the advantages and disadvantages of various model categories to identify more potentially competitive HNE frameworks.We also summarize the application fields,benchmark datasets,open source tools,andperformance evaluation in theHNEarea.Finally,wediscuss open issues and suggest promising future directions.We anticipate that this survey will provide deep insights into research in the field of HNE. 展开更多
关键词 heterogeneous information networks representation learning heterogeneous network embedding graph neural networks machine learning
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Heterogeneous Hyperedge Convolutional Network
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作者 Yong Wu Binjun Wang Wei Li 《Computers, Materials & Continua》 SCIE EI 2020年第12期2277-2294,共18页
Graph convolutional networks(GCNs)have been developed as a general and powerful tool to handle various tasks related to graph data.However,current methods mainly consider homogeneous networks and ignore the rich seman... Graph convolutional networks(GCNs)have been developed as a general and powerful tool to handle various tasks related to graph data.However,current methods mainly consider homogeneous networks and ignore the rich semantics and multiple types of objects that are common in heterogeneous information networks(HINs).In this paper,we present a Heterogeneous Hyperedge Convolutional Network(HHCN),a novel graph convolutional network architecture that operates on HINs.Specifically,we extract the rich semantics by different metastructures and adopt hyperedge to model the interactions among metastructure-based neighbors.Due to the powerful information extraction capabilities of metastructure and hyperedge,HHCN has the flexibility to model the complex relationships in HINs by setting different combinations of metastructures and hyperedges.Moreover,a metastructure attention layer is also designed to allow each node to select the metastructures based on their importance and provide potential interpretability for graph analysis.As a result,HHCN can encode node features,metastructure-based semantics and hyperedge information simultaneously by aggregating features from metastructure-based neighbors in a hierarchical manner.We evaluate HHCN by applying it to the semi-supervised node classification task.Experimental results show that HHCN outperforms state-of-the-art graph embedding models and recently proposed graph convolutional network models. 展开更多
关键词 graph convolutional networks heterogeneous information networks metastructure
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A lightweight false alarm suppression method in heterogeneous change detection
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作者 XU Cong HE Zishu LIU Haicheng 《Journal of Systems Engineering and Electronics》 SCIE CSCD 2024年第4期899-905,共7页
Overlooking the issue of false alarm suppression in heterogeneous change detection leads to inferior detection per-formance.This paper proposes a method to handle false alarms in heterogeneous change detection.A light... Overlooking the issue of false alarm suppression in heterogeneous change detection leads to inferior detection per-formance.This paper proposes a method to handle false alarms in heterogeneous change detection.A lightweight network of two channels is bulit based on the combination of convolutional neural network(CNN)and graph convolutional network(GCN).CNNs learn feature difference maps of multitemporal images,and attention modules adaptively fuse CNN-based and graph-based features for different scales.GCNs with a new kernel filter adaptively distinguish between nodes with the same and those with different labels,generating change maps.Experimental evaluation on two datasets validates the efficacy of the pro-posed method in addressing false alarms. 展开更多
关键词 convolutional neural network(CNN) graph convolu-tional network(GCN) heterogeneous change detection LIGHTWEIGHT false alarm suppression
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Topology-aware tensor decomposition for meta-graph learning
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作者 Hansi Yang Quanming Yao 《CAAI Transactions on Intelligence Technology》 2025年第3期891-901,共11页
Heterogeneous graphs generally refer to graphs with different types of nodes and edges.A common approach for extracting useful information from heterogeneous graphs is to use meta-graphs,which can be seen as a special... Heterogeneous graphs generally refer to graphs with different types of nodes and edges.A common approach for extracting useful information from heterogeneous graphs is to use meta-graphs,which can be seen as a special kind of directed acyclic graph with same node and edge types as the heterogeneous graph.However,how to design proper metagraphs is challenging.Recently,there have been many works on learning suitable metagraphs from a heterogeneous graph.Existing methods generally introduce continuous weights for edges that are independent of each other,which ignores the topological structures of meta-graphs and can be ineffective.To address this issue,the authors propose a new viewpoint from tensor on learning meta-graphs.Such a viewpoint not only helps interpret the limitation of existing works by CANDECOMP/PARAFAC(CP)decomposition,but also inspires us to propose a topology-aware tensor decomposition,called TENSUS,that reflects the structure of DAGs.The proposed topology-aware tensor decomposition is easy to use and simple to implement,and it can be taken as a plug-in part to upgrade many existing works,including node classification and recommendation on heterogeneous graphs.Experimental results on different tasks demonstrate that the proposed method can significantly improve the state-of-the-arts for all these tasks. 展开更多
关键词 graph neural network heterogeneous graph polymorphic network tensor decomposition
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DNMKG: A method for constructing domain of nonferrous metals knowledge graph based on multiple corpus
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作者 Hai-liang LI Hai-dong WANG 《Transactions of Nonferrous Metals Society of China》 2025年第8期2790-2802,共13页
To address the underutilization of Chinese research materials in nonferrous metals,a method for constructing a domain of nonferrous metals knowledge graph(DNMKG)was established.Starting from a domain thesaurus,entitie... To address the underutilization of Chinese research materials in nonferrous metals,a method for constructing a domain of nonferrous metals knowledge graph(DNMKG)was established.Starting from a domain thesaurus,entities and relationships were mapped as resource description framework(RDF)triples to form the graph’s framework.Properties and related entities were extracted from open knowledge bases,enriching the graph.A large-scale,multi-source heterogeneous corpus of over 1×10^(9) words was compiled from recent literature to further expand DNMKG.Using the knowledge graph as prior knowledge,natural language processing techniques were applied to the corpus,generating word vectors.A novel entity evaluation algorithm was used to identify and extract real domain entities,which were added to DNMKG.A prototype system was developed to visualize the knowledge graph and support human−computer interaction.Results demonstrate that DNMKG can enhance knowledge discovery and improve research efficiency in the nonferrous metals field. 展开更多
关键词 knowledge graph nonferrous metals THESAURUS word vector model multi-source heterogeneous corpus
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Adaptive multi-view learning method for enhanced drug repurposing using chemical-induced transcriptional profiles, knowledge graphs, and large language models
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作者 Yudong Yan Yinqi Yang +9 位作者 Zhuohao Tong Yu Wang Fan Yang Zupeng Pan Chuan Liu Mingze Bai Yongfang Xie Yuefei Li Kunxian Shu Yinghong Li 《Journal of Pharmaceutical Analysis》 2025年第6期1354-1369,共16页
Drug repurposing offers a promising alternative to traditional drug development and significantly re-duces costs and timelines by identifying new therapeutic uses for existing drugs.However,the current approaches ofte... Drug repurposing offers a promising alternative to traditional drug development and significantly re-duces costs and timelines by identifying new therapeutic uses for existing drugs.However,the current approaches often rely on limited data sources and simplistic hypotheses,which restrict their ability to capture the multi-faceted nature of biological systems.This study introduces adaptive multi-view learning(AMVL),a novel methodology that integrates chemical-induced transcriptional profiles(CTPs),knowledge graph(KG)embeddings,and large language model(LLM)representations,to enhance drug repurposing predictions.AMVL incorporates an innovative similarity matrix expansion strategy and leverages multi-view learning(MVL),matrix factorization,and ensemble optimization techniques to integrate heterogeneous multi-source data.Comprehensive evaluations on benchmark datasets(Fdata-set,Cdataset,and Ydataset)and the large-scale iDrug dataset demonstrate that AMVL outperforms state-of-the-art(SOTA)methods,achieving superior accuracy in predicting drug-disease associations across multiple metrics.Literature-based validation further confirmed the model's predictive capabilities,with seven out of the top ten predictions corroborated by post-2011 evidence.To promote transparency and reproducibility,all data and codes used in this study were open-sourced,providing resources for pro-cessing CTPs,KG,and LLM-based similarity calculations,along with the complete AMVL algorithm and benchmarking procedures.By unifying diverse data modalities,AMVL offers a robust and scalable so-lution for accelerating drug discovery,fostering advancements in translational medicine and integrating multi-omics data.We aim to inspire further innovations in multi-source data integration and support the development of more precise and efficient strategies for advancing drug discovery and translational medicine. 展开更多
关键词 Drug repurposing Multi-view learning Chemical-induced transcriptional profile Knowledge graph Large language model heterogeneous network
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同质性增强的异构图提示学习方法
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作者 魏楚元 刘舜尧 +4 位作者 卓胜达 张蕾 王昌栋 黄书强 刘杰 《小型微型计算机系统》 北大核心 2026年第1期97-105,共9页
图神经网络在多个不同领域展现出巨大潜力,然而传统的图神经网络方法通常依赖大量标注数据进行训练,而在实际应用中,标注大量数据往往代价高昂且费时费力.近年来,提示学习作为一种新兴的预训练模型范式,在Few-shot、Zero-shot等低资源... 图神经网络在多个不同领域展现出巨大潜力,然而传统的图神经网络方法通常依赖大量标注数据进行训练,而在实际应用中,标注大量数据往往代价高昂且费时费力.近年来,提示学习作为一种新兴的预训练模型范式,在Few-shot、Zero-shot等低资源场景中表现出色.图提示学习是一种新颖的图预训练和提示框架,能够通过少量标注数据实现图数据的多任务处理,有效弥合预训练任务与下游任务之间的差距.然而,现有图提示学习方法在处理异构图时,忽视了图数据复杂的内在结构,特别是未能充分挖掘异构图中蕴含的同质性特征.为了解决该问题,本文提出了一种同质性增强的异构图提示学习方法,旨在提升图神经网络在异构图中的表现.具体而言,设计了基于元路径的同质子图提取方法,并结合同质性软聚类技术,有效捕捉节点间的节点相似性关系,从而优化图提示效果.实验结果表明,所提出的方法在多个基准数据集上优于现有技术,表现出更强的性能和效果. 展开更多
关键词 图神经网络 图提示学习 异构图 同质性 元路径
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川滇地区人工智能地震预测模型应用
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作者 孟令媛 胡峰 +7 位作者 臧阳 司旭 闫伟 田雷 赵小艳 张致伟 韩颜颜 王月 《地震研究》 北大核心 2026年第1期43-50,共8页
针对中国地震科学实验场的科学目标和主要科学问题,基于川滇地区地震目录和地球物理观测数据,在对川滇地区进行区域划分并建立图神经网络的基础上,构建了川滇地区地震预测模型。该模型综合考虑约3万条地震目录数据、基于地震目录的3种... 针对中国地震科学实验场的科学目标和主要科学问题,基于川滇地区地震目录和地球物理观测数据,在对川滇地区进行区域划分并建立图神经网络的基础上,构建了川滇地区地震预测模型。该模型综合考虑约3万条地震目录数据、基于地震目录的3种地震活动性参数,以及116台项地球物理观测数据,通过将传统经验预测指标方法与人工智能技术结合,给出了适用于川滇地区的多源异构数据图神经网络地震预测模型,实现了川滇地区不同数据源下短期与中期地震预测功能。模型应用结果显示,在CD2、CD8和CD10区域月尺度预测效果较好,年尺度无震预测有一定对应效果。 展开更多
关键词 中国地震科学实验场 多源异构数据 图神经网络 地震预测模型 川滇地区
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