How lipids suppress cavitation in biological fluids.

IF 9.7 1区 化学 Q1 CHEMISTRY, PHYSICAL
Marin Šako, Steven Jansen, H Jochen Schenk, Roland R Netz, Emanuel Schneck, Matej Kanduč
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引用次数: 0

Abstract

Hypothesis: Cavitation in water under tension is often initiated at nanoscale hydrophobic surface defects that stabilize preexisting nanobubbles. We hypothesize that amphiphilic molecules, such as polar lipids, can adsorb onto these defects and suppress cavitation by removing nanobubble nucleation sites.

Simulations: To test this mechanism, we performed atomistic molecular dynamics simulations in combination with classical nucleation theory to model lipid bilayers and monolayer coatings at hydrophobic surfaces containing nanoscale pits and to investigate their response to applied negative pressures.

Findings: We find that lipids readily adsorb onto hydrophobic surfaces, conform to nanoscale features, and eliminate bubble-hosting cavities. This passivation shifts the cavitation-limiting step from nanobubble expansion at defects to rupture of lipid bilayers, which exhibit much higher cavitation resistance. These results provide a molecular basis for how amphiphilic additives enhance the stability of aqueous liquids against cavitation, even in the presence of unavoidable surface imperfections. This mechanism also offers a physically grounded explanation for how vascular plants sustain sap transport under substantial negative pressures despite structural heterogeneities in their water-conducting vessels.

脂质如何抑制生物流体中的空化。
假设:在张力作用下,水的空化通常是在纳米级疏水表面缺陷处开始的,这些缺陷稳定了先前存在的纳米气泡。我们假设两亲性分子,如极性脂质,可以吸附在这些缺陷上,并通过去除纳米泡成核位点来抑制空化。模拟:为了测试这一机制,我们结合经典成核理论进行了原子分子动力学模拟,模拟了含有纳米级凹坑的疏水表面的脂质双层和单层涂层,并研究了它们对施加负压的反应。研究结果:我们发现脂质很容易吸附在疏水表面上,符合纳米尺度特征,并消除气泡腔。这种钝化将限制空化的步骤从缺陷处的纳米气泡膨胀转变为脂质双分子层的破裂,从而表现出更高的抗空化能力。这些结果为两亲性添加剂如何增强水性液体抗空化的稳定性提供了分子基础,即使在不可避免的表面缺陷存在的情况下。这一机制也为维管植物如何在巨大的负压下维持汁液运输提供了物理基础的解释,尽管它们的导水容器结构不均匀。
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来源期刊
CiteScore
16.10
自引率
7.10%
发文量
2568
审稿时长
2 months
期刊介绍: The Journal of Colloid and Interface Science publishes original research findings on the fundamental principles of colloid and interface science, as well as innovative applications in various fields. The criteria for publication include impact, quality, novelty, and originality. Emphasis: The journal emphasizes fundamental scientific innovation within the following categories: A.Colloidal Materials and Nanomaterials B.Soft Colloidal and Self-Assembly Systems C.Adsorption, Catalysis, and Electrochemistry D.Interfacial Processes, Capillarity, and Wetting E.Biomaterials and Nanomedicine F.Energy Conversion and Storage, and Environmental Technologies
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