Multiscale modelling of active hydrogel elasticity driven by living polymers: softening by bacterial motor protein FtsZ†

IF 2.8 3区 化学 Q3 CHEMISTRY, PHYSICAL Soft Matter Pub Date : 2024-12-27 DOI:10.1039/D4SM00839A
Horacio López-Menéndez, Clara Luque-Rioja, Mikheil Kharbedia, Diego Herráez-Aguilar, José A. Santiago and Francisco Monroy
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Abstract

We present a neo-Hookean elasticity theory for hybrid mechano-active hydrogels, integrating motor proteins into polymer meshes to create composite materials with active softening due to modulable chain overlaps. Focusing on polyacrylamide (PA) hydrogels embedded with FtsZ, a bacterial cytokinetic protein powered by GTP, we develop a multiscale model using microscopic Flory theory of rubbery meshes through mesoscopic De Gennes’ scaling concepts for meshwork dynamics and phenomenological Landau's formalism for second-order phase transitions. Our theoretical multiscale model explains the active softening observed in hybrid FtsZ-PA hydrogels by incorporating modulable meshwork dynamics, such as overlapping functionality and reptation dynamics, into an active mean-field of unbinding interactions. The novel FtsZ-based metamaterial and companion multiscale theory offer insights for designing, predicting, and controlling complex active hydrogels, with potential applications in technology and biomedicine.

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由活聚合物驱动的活性水凝胶弹性的多尺度建模:细菌运动蛋白FtsZ的软化。
我们提出了混合机械活性水凝胶的新胡克弹性理论,将马达蛋白整合到聚合物网格中,以创建由于可调链重叠而具有活性软化的复合材料。我们以嵌入FtsZ(一种由GTP驱动的细菌细胞动力学蛋白)的聚丙烯酰胺(PA)水凝胶为研究对象,通过介观De Gennes的网状动力学尺度概念和现象Landau的二阶相变形式,利用微观Flory理论建立了一个多尺度模型。我们的理论多尺度模型解释了混合FtsZ-PA水凝胶中观察到的主动软化现象,该模型将可调的网络动力学(如重叠功能和重复动力学)纳入主动的解结合相互作用平均场中。基于ftsz的新型超材料及其配套的多尺度理论为复杂活性水凝胶的设计、预测和控制提供了新的见解,在技术和生物医学领域具有潜在的应用前景。
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来源期刊
Soft Matter
Soft Matter 工程技术-材料科学:综合
CiteScore
6.00
自引率
5.90%
发文量
891
审稿时长
1.9 months
期刊介绍: Soft Matter is an international journal published by the Royal Society of Chemistry using Engineering-Materials Science: A Synthesis as its research focus. It publishes original research articles, review articles, and synthesis articles related to this field, reporting the latest discoveries in the relevant theoretical, practical, and applied disciplines in a timely manner, and aims to promote the rapid exchange of scientific information in this subject area. The journal is an open access journal. The journal is an open access journal and has not been placed on the alert list in the last three years.
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