Enhancing drug recovery efficiency: A numerical solution approach with electromembrane extraction modeling

IF 7.9 Q1 ENGINEERING, MULTIDISCIPLINARY
Fatemeh Mansouri, Ahmad Rahbar-kelishami
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引用次数: 0

Abstract

Electromembrane extraction (EME) has gained attention as an efficient alternative to conventional sample preparation, yet the mechanistic understanding of coupled electrokinetic and mass transport phenomena remains limited. To address this gap, we developed a numerical framework based on the coupled Poisson–Nernst–Planck equations, solved via the finite element method in COMSOL Multiphysics, to investigate the extraction of basic and acidic drugs under realistic partitioning conditions. A comprehensive parametric study was conducted, examining the effects of applied voltage, donor/acceptor phase pH, membrane thickness, drug diffusivity, porosity, initial concentration, and extraction time. The results revealed a strong correlation between flux and potential difference across the supported liquid membrane: extraction recovery increased from 46 % to nearly 100 % when the voltage was raised from 5 to 30 V. Moreover, a maximum recovery of 97.6 % was achieved at a donor phase pH of 2. Sensitivity to membrane thickness and drug diffusivity was also confirmed, highlighting the importance of partitioning effects on extraction performance. These findings provide mechanistic insights and practical guidelines for optimizing EME, with direct relevance to pharmaceutical separations and environmentally sustainable drug recovery. Beyond advancing fundamental understanding, these insights can support the design of more sustainable and efficient pharmaceutical separation processes, thereby facilitating both research development and potential industrial applications in drug recovery and purification.
提高药物回收效率:电膜萃取模型的数值求解方法
电膜萃取(EME)作为传统样品制备的一种有效替代方法而受到关注,但对耦合电动力学和质量传递现象的机理理解仍然有限。为了解决这一问题,我们开发了一个基于泊松-能斯特-普朗克耦合方程的数值框架,通过COMSOL Multiphysics中的有限元方法求解,研究了在实际分配条件下碱性和酸性药物的提取。进行了一项综合参数研究,考察了施加电压、供体/受体相pH、膜厚度、药物扩散率、孔隙度、初始浓度和提取时间的影响。结果表明,负载液膜上的通量和电位差之间存在很强的相关性:当电压从5 V提高到30 V时,萃取回收率从46%提高到近100%。供体pH为2时,回收率最高可达97.6%。对膜厚度和药物扩散率的敏感性也得到了证实,强调了分配效应对提取性能的重要性。这些发现为优化EME提供了机制见解和实用指南,与药物分离和环境可持续药物回收直接相关。除了推进基本的理解,这些见解可以支持设计更可持续和有效的药物分离过程,从而促进药物回收和纯化的研究开发和潜在的工业应用。
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
Results in Engineering
Results in Engineering Engineering-Engineering (all)
CiteScore
5.80
自引率
34.00%
发文量
441
审稿时长
47 days
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