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基于多视图对比学习的解耦图神经网络用于单细胞RNA测序数据聚类

Decoupled GNNs based on multi-view contrastive learning for scRNA-seq data clustering.

作者信息

Yu Xiaoyan, Ren Yixuan, Xia Min, Shu Zhenqiu, Zhu Liehuang

机构信息

School of Computer Science and Technology, Beijing Institute of Technology, Zhongguancun South Street, Haidian, Beijing, 100081, China.

Faculty of Information Engineering and Automation, Kunming University of Science and Technology, Jingming South Road, Chenggong, Kunming, Yunnan, 650500, China.

出版信息

Brief Bioinform. 2025 May 1;26(3). doi: 10.1093/bib/bbaf198.

DOI:10.1093/bib/bbaf198
PMID:40366859
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC12077398/
Abstract

Clustering is pivotal in deciphering cellular heterogeneity in single-cell RNA sequencing (scRNA-seq) data. However, it suffers from several challenges in handling the high dimensionality and complexity of scRNA-seq data. Especially when employing graph neural networks (GNNs) for cell clustering, the dependencies between cells expand exponentially with the number of layers. This results in high computational complexity, negatively impacting the model's training efficiency. To address these challenges, we propose a novel approach, called decoupled GNNs, based on multi-view contrastive learning (scDeGNN), for scRNA-seq data clustering. Firstly, this method constructs two adjacency matrices to generate distinct views, and trains them using decoupled GNNs to derive the initial cell feature representations. These representations are then refined through a multilayer perceptron and a contrastive learning layer, ensuring the consistency and discriminability of the learned features. Finally, the learned representations are fused and applied to the cell clustering task. Extensive experimental results on nine real scRNA-seq datasets from various organisms and tissues show that the proposed scDeGNN method significantly outperforms other state-of-the-art scRNA-seq data clustering algorithms across multiple evaluation metrics.

摘要

聚类在解读单细胞RNA测序(scRNA-seq)数据中的细胞异质性方面至关重要。然而,它在处理scRNA-seq数据的高维度和复杂性时面临若干挑战。特别是在使用图神经网络(GNN)进行细胞聚类时,细胞之间的依赖性会随着层数呈指数级增长。这导致计算复杂度很高,对模型的训练效率产生负面影响。为了应对这些挑战,我们提出了一种基于多视图对比学习的新颖方法,称为解耦GNN(scDeGNN),用于scRNA-seq数据聚类。首先,该方法构建两个邻接矩阵以生成不同的视图,并使用解耦GNN对其进行训练,以获得初始细胞特征表示。然后,通过多层感知器和对比学习层对这些表示进行优化,确保所学习特征的一致性和可区分性。最后,将所学习的表示进行融合,并应用于细胞聚类任务。对来自各种生物体和组织的九个真实scRNA-seq数据集进行的大量实验结果表明,所提出的scDeGNN方法在多个评估指标上显著优于其他最先进的scRNA-seq数据聚类算法。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/1ead/12077398/478d5dc81d44/bbaf198f4.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/1ead/12077398/51ee8e8b143b/bbaf198f1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/1ead/12077398/b3e8239e37b1/bbaf198f2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/1ead/12077398/cecceaf18070/bbaf198f3.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/1ead/12077398/478d5dc81d44/bbaf198f4.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/1ead/12077398/51ee8e8b143b/bbaf198f1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/1ead/12077398/b3e8239e37b1/bbaf198f2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/1ead/12077398/cecceaf18070/bbaf198f3.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/1ead/12077398/478d5dc81d44/bbaf198f4.jpg

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本文引用的文献

1
Multi-level multi-view network based on structural contrastive learning for scRNA-seq data clustering.基于结构对比学习的多层次多视图网络用于 scRNA-seq 数据聚类。
Brief Bioinform. 2024 Sep 23;25(6). doi: 10.1093/bib/bbae562.
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scDFN: enhancing single-cell RNA-seq clustering with deep fusion networks.scDFN:利用深度融合网络增强单细胞 RNA-seq 聚类
Brief Bioinform. 2024 Sep 23;25(6). doi: 10.1093/bib/bbae486.
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Decouple Graph Neural Networks: Train Multiple Simple GNNs Simultaneously Instead of One.解耦图神经网络:同时训练多个简单的图神经网络而非一个。
IEEE Trans Pattern Anal Mach Intell. 2024 Nov;46(11):7451-7462. doi: 10.1109/TPAMI.2024.3392782. Epub 2024 Oct 3.
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scMGCN: A Multi-View Graph Convolutional Network for Cell Type Identification in scRNA-seq Data.scMGCN:用于 scRNA-seq 数据中细胞类型识别的多视图图卷积网络。
Int J Mol Sci. 2024 Feb 13;25(4):2234. doi: 10.3390/ijms25042234.
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scPML: pathway-based multi-view learning for cell type annotation from single-cell RNA-seq data.scPML:基于通路的单细胞 RNA-seq 数据的细胞类型注释的多视图学习。
Commun Biol. 2023 Dec 14;6(1):1268. doi: 10.1038/s42003-023-05634-z.
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scFseCluster: a feature selection-enhanced clustering for single-cell RNA-seq data.scFseCluster:一种用于单细胞 RNA-seq 数据的特征选择增强聚类方法。
Life Sci Alliance. 2023 Oct 3;6(12). doi: 10.26508/lsa.202302103. Print 2023 Dec.
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Self-supervised deep clustering of single-cell RNA-seq data to hierarchically detect rare cell populations.基于单细胞 RNA-seq 数据的自监督深度聚类来分层检测稀有细胞群体。
Brief Bioinform. 2023 Sep 22;24(6). doi: 10.1093/bib/bbad335.
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scAAGA: Single cell data analysis framework using asymmetric autoencoder with gene attention.scAAGA:使用具有基因注意力的不对称自动编码器的单细胞数据分析框架。
Comput Biol Med. 2023 Oct;165:107414. doi: 10.1016/j.compbiomed.2023.107414. Epub 2023 Aug 30.
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Bioinformatics. 2023 Jun 1;39(6). doi: 10.1093/bioinformatics/btad342.
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