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Updated: Jun 18, 2025

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ZMPY3D:通过向量化3DZernike时刻和基于Python的GPU集成加速蛋白质结构体积分析

Jhih-Siang Lai1, Stephen K Burley1,2,3,4, Jose M Duarte1

  • 1Research Collaboratory for Structural Bioinformatics Protein Data Bank, San Diego Supercomputer Center, University of California, La Jolla, CA 92093, United States.

Bioinformatics advances
|August 5, 2024
PubMed
概括

本研究介绍了ZMPY3D,这是一个Python包,可以加速用于结构生物学的3DZernike时刻计算. 它增强了对大型蛋白质结构数据集的分析,促进了与人工智能/机器学习工具的整合.

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