A Comprehensive Numerical Study on the Transport and Deposition of Nasal Sprayed Pharmaceutical Aerosols in a Nasal‐To‐Lung Respiratory Tract Model

IF 2.7 4区 材料科学 Q3 CHEMISTRY, PHYSICAL Particle & Particle Systems Characterization Pub Date : 2024-08-23 DOI:10.1002/ppsc.202400004
Xinlei Huang, Yaohui Yin, Goutam Saha, Isabella Francis, Suvash C. Saha
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Abstract

Utilizing a computed tomography (CT)‐based realistic nasal‐to‐lung respiratory tract model allows for a comprehensive investigation of the transport and deposition of nasal sprayed aerosols. This study has three main objectives: first, to determine the optimal mesh that achieves the quickest convergence for computational fluid‐particle dynamics (CFPD) simulations of a nasal‐to‐lung nasal respiratory tract by assessing the performance of different element types, sizes, and prism boundary layers; second, to design and validate a numerical method to compare grid data with different mesh structures and densities for simulation result validation; and finally, to observe and analyze fluid‐particle dynamics in the respiratory tract to aid in the development of nasal sprayed medications. This study involves reverse‐engineering a realistic and anatomically accurate respiratory tract model from CT scans. Results reveal that the optimal numerical approach for minimum calculation time is the polyhedral hybrid mesh with four boundary prism layers and the SIMPLE pressure‐velocity coupling scheme. Furthermore, observations of particle dynamics reveal that the vocal cords' location contains a concentration site of deposited small aerosols due to the turbulent airflow in the region. The optimal diameters of nasal sprayed aerosols to target each region are concluded in the end.
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鼻腔至肺部呼吸道模型中鼻腔喷雾药用气溶胶迁移和沉积的综合数值研究
利用基于计算机断层扫描(CT)的逼真鼻腔至肺部呼吸道模型,可以对鼻腔喷雾气溶胶的传输和沉积进行全面研究。这项研究有三个主要目标:首先,通过评估不同元素类型、尺寸和棱柱边界层的性能,确定在计算流体-粒子动力学(CFPD)模拟鼻-肺鼻腔呼吸道时收敛最快的最佳网格;其次,设计并验证一种数值方法,用于比较不同网格结构和密度的网格数据,以验证模拟结果;最后,观察并分析呼吸道中的流体-粒子动力学,以帮助开发鼻腔喷雾药物。这项研究包括根据 CT 扫描结果逆向设计一个逼真且解剖精确的呼吸道模型。结果表明,计算时间最短的最佳数值方法是具有四个边界棱柱层的多面体混合网格和 SIMPLE 压力-速度耦合方案。此外,对粒子动力学的观察显示,声带位置是小气溶胶沉积的集中地,原因是该区域气流紊乱。最后得出了针对每个区域的鼻腔喷雾气溶胶的最佳直径。
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来源期刊
Particle & Particle Systems Characterization
Particle & Particle Systems Characterization 工程技术-材料科学:表征与测试
CiteScore
5.50
自引率
0.00%
发文量
114
审稿时长
3.0 months
期刊介绍: Particle & Particle Systems Characterization is an international, peer-reviewed, interdisciplinary journal focusing on all aspects of particle research. The journal joined the Advanced Materials family of journals in 2013. Particle has an impact factor of 4.194 (2018 Journal Impact Factor, Journal Citation Reports (Clarivate Analytics, 2019)). Topics covered include the synthesis, characterization, and application of particles in a variety of systems and devices. Particle covers nanotubes, fullerenes, micelles and alloy clusters, organic and inorganic materials, polymers, quantum dots, 2D materials, proteins, and other molecular biological systems. Particle Systems include those in biomedicine, catalysis, energy-storage materials, environmental science, micro/nano-electromechanical systems, micro/nano-fluidics, molecular electronics, photonics, sensing, and others. Characterization methods include microscopy, spectroscopy, electrochemical, diffraction, magnetic, and scattering techniques.
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