Spatiotemporal Pathway Control for Targeted Drug Delivery: A unified Waveform Modulation in Molecular Communication.

IF 4.4 4区 生物学 Q1 BIOCHEMICAL RESEARCH METHODS
Ming Tan, Yue Sun, Hanyu Xiao, Yifan Chen
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Abstract

Precise control of drug delivery requires coordination across multiple stages, including release timing, propagation dynamics, and targeting efficiency. To address this, a unified waveform modulation framework inspired by molecular communication (MC), under the broader concept of nanoparticle beamforming, is proposed to enable full-chain control over nanoparticle (NP) behavior from release through propagation to reception. Within this framework, pathway optimization is considered as a key component of channel-level pathway control and is implemented via magnetic-field-assisted navigation. The framework supports therapeutic-window regulation across diverse agents for safe and efficient delivery. Magnetic navigation is embedded spatiotemporal pathway control into channel-level routing to guide NPs through the vascular network. COMSOL Multiphysics simulations are used to model NP motion under magnetic spatiotemporal pathway control conditions. Two representative drugs with contrasting therapeutic windows, Digoxin (narrow window) and Ibuprofen (wide window), are used as case studies to evaluate the adaptability of the framework. Key evaluation metrics include maintaining the localized drug concentration between the minimum effective concentration (MEC) and the minimum toxic concentration (MTC).The COMSOL simulations indicate that magnetic-field-assisted pathway control can improve NP accumulation at the target region, with a 75.3% increase in successful targeting rate compared to the case without magnetic-field control. When integrated into the waveform modulation framework, this pathway optimization helps maintain drug concentrations within the therapeutic window for both case studies. For Ibuprofen, effective levels are sustained over a wide range, while for Digoxin, the system supports tighter regulation to reduce the risk of toxicity. These results suggest the potential of waveform modulation as a unifying control paradigm for drug delivery across the release, propagation, and target stages. Implementing magnetic pathway control at the channel level supports the applicability of the framework under the modeled vascular constraints. The results suggest its potential for generalizable and personalized delivery strategies in diverse therapeutic scenarios.

靶向药物递送的时空通路控制:分子通信中的统一波形调制。
药物传递的精确控制需要多个阶段的协调,包括释放时间、传播动力学和靶向效率。为了解决这个问题,在更广泛的纳米粒子波束形成概念下,提出了一个受分子通信(MC)启发的统一波形调制框架,以实现对纳米粒子(NP)行为从释放到传播到接收的全链控制。在此框架下,路径优化被认为是通道级路径控制的关键组成部分,并通过磁场辅助导航实现。该框架支持跨多种药物的治疗窗口调节,以实现安全有效的给药。磁导航将时空路径控制嵌入到通道级路由中,以引导NPs通过血管网络。利用COMSOL多物理场仿真技术模拟了磁性时空路径控制条件下的NP运动。以地高辛(窄窗)和布洛芬(宽窗)两种具有对照治疗窗的代表性药物作为案例研究,评估该框架的适应性。关键评价指标包括局部药物浓度保持在最小有效浓度(MEC)和最小毒性浓度(MTC)之间。COMSOL模拟表明,磁场辅助路径控制可以改善目标区域的NP积累,与没有磁场控制的情况相比,成功瞄准率提高了75.3%。当整合到波形调制框架中时,该途径优化有助于将药物浓度维持在两个案例研究的治疗窗口内。对于布洛芬,有效水平在很大范围内维持,而对于地高辛,系统支持更严格的监管以减少毒性风险。这些结果表明,波形调制作为药物释放、传播和靶阶段的统一控制范式的潜力。在通道级实现磁通路控制支持了该框架在建模血管约束下的适用性。结果表明,在不同的治疗方案中,它具有推广和个性化递送策略的潜力。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
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来源期刊
IEEE Transactions on NanoBioscience
IEEE Transactions on NanoBioscience 工程技术-纳米科技
CiteScore
7.00
自引率
5.10%
发文量
197
审稿时长
>12 weeks
期刊介绍: The IEEE Transactions on NanoBioscience reports on original, innovative and interdisciplinary work on all aspects of molecular systems, cellular systems, and tissues (including molecular electronics). Topics covered in the journal focus on a broad spectrum of aspects, both on foundations and on applications. Specifically, methods and techniques, experimental aspects, design and implementation, instrumentation and laboratory equipment, clinical aspects, hardware and software data acquisition and analysis and computer based modelling are covered (based on traditional or high performance computing - parallel computers or computer networks).
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