Optimizing clustering of CDR3 sequences using natural language processing, Word2Vec, and KMeans

利用自然语言处理、Word2Vec 和 KMeans 方法优化 CDR3 序列聚类。

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Abstract

T-cell receptor (TCR) sequencing has emerged as a powerful tool for understanding adaptive immune responses, yet challenges persist in deciphering the immense diversity of Complementarity-Determining Region 3 (CDR3) sequences. This study presents a novel natural language processing (NLP)-based pipeline to cluster CDR3 sequences from TCR β-chain repertoires using Word2Vec embeddings, principal component analysis (PCA), and KMeans clustering. Focusing on Acute Respiratory Distress Syndrome (ARDS), a life-threatening inflammatory lung condition, we trained Word2Vec models on healthy controls and applied unsupervised clustering across ARDS, non-ARDS, and control datasets. Dimensionality-reduced embeddings revealed clear distinctions in repertoire structure: control samples exhibited tight, low-diversity clusters; ARDS patients showed high dispersion and numerous diffuse clusters indicative of repertoire disruption; and non-ARDS samples displayed intermediate organization. These differences suggest that immune activation states are embedded in the structural topology of the CDR3 space. Our framework successfully captured these latent patterns, offering a scalable approach to biomarker discovery. This study not only reinforces the utility of NLP in immunological analysis but also paves the way for data-driven immune monitoring in critical care and personalized diagnostics.

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