Hydrophobic and Hydrophilic Interactions

疏水和亲水相互作用
  • 文章类型: Journal Article
    肺部给药由于其靶向的局部肺部作用而引起了极大的关注,最小的毒副作用,和高药物利用率。然而,作为药物载体的吸入纳米颗粒(NPs)的物理化学性质可以影响它们与肺表面活性物质(PS)单层的相互作用,可能改变NP的命运并损害PS单层的生物物理功能。因此,这篇综述的目的是总结NPs的物理化学性质如何影响它们与PS单层的相互作用。最初,NP的定义和属性,以及PS单层的组成和特性,被介绍。随后,提出了用于研究NP与PS单层之间相互作用的粗粒分子动力学(CGMD)模拟方法。最后,疏水性的含义,尺寸,形状,表面电荷,表面改性,讨论了NPs与PS单层的相互作用以及生物分子电晕的组成。总之,深入了解NPs的物理化学性质对其与PS单层相互作用的影响将有助于开发更安全,更有效的肺部药物纳米药物。
    Pulmonary drug delivery has garnered significant attention due to its targeted local lung action, minimal toxic side effects, and high drug utilization. However, the physicochemical properties of inhaled nanoparticles (NPs) used as drug carriers can influence their interactions with the pulmonary surfactant (PS) monolayer, potentially altering the fate of the NPs and impairing the biophysical function of the PS monolayer. Thus, the objective of this review is to summarize how the physicochemical properties of NPs affect their interactions with the PS monolayer. Initially, the definition and properties of NPs, as well as the composition and characteristics of the PS monolayer, are introduced. Subsequently, the coarse-grained molecular dynamics (CGMD) simulation method for studying the interactions between NPs and the PS monolayer is presented. Finally, the implications of the hydrophobicity, size, shape, surface charge, surface modification, and aggregation of NPs on their interactions with the PS monolayer and on the composition of biomolecular corona are discussed. In conclusion, gaining a deeper understanding of the effects of the physicochemical properties of NPs on their interactions with the PS monolayer will contribute to the development of safer and more effective nanomedicines for pulmonary drug delivery.
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  • 文章类型: Journal Article
    由于通过亲核取代进行修饰,糖类和生物化合物作为糖(糖)复合物在活生物体中具有各种作用和生物学功能,聚合,和复杂的形成反应。大多数情况下,mono-,di-,寡头-,多糖被稳定成非活性的糖苷,它们是在代谢途径中形成的。天然糖类在食品和环境监测中具有重要意义。具有各种功能的糖苷在临床和医学研究中具有重要意义。糖类常用亲水作用液相色谱和阴离子交换色谱等色谱方法研究,还有毛细管电泳和质谱及其在线耦合系统。样品制备在糖类化合物的鉴定中很重要。这里讨论的案例集中在生物科学上,临床,和食品应用。
    Saccharides and biocompounds as saccharide (sugar) complexes have various roles and biological functions in living organisms due to modifications via nucleophilic substitution, polymerization, and complex formation reactions. Mostly, mono-, di-, oligo-, and polysaccharides are stabilized to inactive glycosides, which are formed in metabolic pathways. Natural saccharides are important in food and environmental monitoring. Glycosides with various functionalities are significant in clinical and medical research. Saccharides are often studied with the chromatographic methods of hydrophilic interaction liquid chromatography and anion exchange chromatograpy, but also with capillary electrophoresis and mass spectrometry with their on-line coupling systems. Sample preparation is important in the identification of saccharide compounds. The cases discussed here focus on bioscience, clinical, and food applications.
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  • 文章类型: Journal Article
    随着石油基包装材料引起的环境和生态问题日益严重,重点已逐渐转移到用于制备功能性食品包装材料的自然资源上。除了可生物降解的性质,纳米纤维素(NC)力学性能,和丰富的表面化学也令人着迷,并希望成为最可能的绿色包装材料之一。在这次审查中,本文首先介绍了数控在食品包装中新型应用的最新进展,包括智能包装,纳米(生物)传感器,和纳米纸;其次,我们专注于NC的改性技术,以总结其性能(抗菌,机械,疏水,抗氧化剂,等等)食品包装所需的,拓展新的合成方法和应用领域。在展示了与材料设计和可持续应用相关的所有最新进展之后,概述了NC的安全性,以促进NC向真正可持续包装领域的持续健康运动。
    With the increasing environmental and ecological problems caused by petroleum-based packaging materials, the focus has gradually shifted to natural resources for the preparation of functional food packaging materials. In addition to biodegradable properties, nanocellulose (NC) mechanical properties, and rich surface chemistry are also fascinating and desired to be one of the most probable green packaging materials. In this review, we firstly introduce the recent progress of novel applications of NC in food packaging, including intelligent packaging, nano(bio)sensors, and nano-paper; secondly, we focus on the modification techniques of NC to summarize the properties (antimicrobial, mechanical, hydrophobic, antioxidant, and so on) that are required for food packaging, to expand the new synthetic methods and application areas. After presenting all the latest advances related to material design and sustainable applications, an overview summarizing the safety of NC is presented to promote a continuous and healthy movement of NC toward the field of truly sustainable packaging.
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  • 文章类型: Journal Article
    色谱法是一种强大而可靠的分离方法,可以使用各种固定相来分离代谢组学中常见的复杂混合物。这篇综述通过质谱(MS)和核磁共振(NMR)光谱等方法研究了靶向或非靶向代谢组学中使用的色谱和固定相的类型。考虑了代谢组学中样品预处理和分离的一般考虑因素,以及已用于此类工作的色谱的各种支持和分离格式。将检查代谢组学中最广泛使用的液相色谱(LC)类型,如反相液相色谱法和亲水液相相互作用色谱法。此外,在代谢组学的更有限应用中使用的其他形式的LC(例如,离子交换,尺寸排除,和亲和方法)将进行讨论,以说明如何将这些技术用于该领域的新研究和未来研究。还讨论了多维LC方法,以及气相色谱和超临界流体色谱在代谢组学中的应用。此外,色谱在NMR-vs.中的作用考虑基于MS的代谢组学。每种类型的色谱在代谢组学领域中都有应用,以及这些分离方法的潜在优点或局限性。
    Chromatography is a robust and reliable separation method that can use various stationary phases to separate complex mixtures commonly seen in metabolomics. This review examines the types of chromatography and stationary phases that have been used in targeted or untargeted metabolomics with methods such as mass spectrometry (MS) and nuclear magnetic resonance (NMR) spectroscopy. General considerations for sample pretreatment and separations in metabolomics are considered, along with the various supports and separation formats for chromatography that have been used in such work. The types of liquid chromatography (LC) that have been most extensively used in metabolomics will be examined, such as reversed-phase liquid chromatography and hydrophilic liquid interaction chromatography. In addition, other forms of LC that have been used in more limited applications for metabolomics (e.g., ion-exchange, size-exclusion, and affinity methods) will be discussed to illustrate how these techniques may be utilized for new and future research in this field. Multidimensional LC methods are also discussed, as well as the use of gas chromatography and supercritical fluid chromatography in metabolomics. In addition, the roles of chromatography in NMR- vs. MS-based metabolomics are considered. Applications are given within the field of metabolomics for each type of chromatography, along with potential advantages or limitations of these separation methods.
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  • 文章类型: Journal Article
    在生物医学领域,生物污染仍然是一个持续的挑战,组织工程,海洋产业,和膜分离过程。多功能水凝胶由于其复杂的三维结构而引起了广泛的关注,亲水性,生物相容性,和灵活性。这些水凝胶已经在各种工程学科中显示出显著的进步。水凝胶的防污功效通常涵盖一系列减轻或抑制颗粒物质粘附的策略。生物实体,或外来污染物在其外部或内部表面上。本文综述了水凝胶的防污性能和应用。我们首先专注于阐明水凝胶固有抗污染的基本原理。然后是对用于增强水凝胶组合物的防污性能的方法进行全面研究,网络结构,电导率,光热特性,活性氧(ROS)的释放,并掺入硅和氟化合物。此外,我们探索了防污水凝胶的新兴前景,以缓解表面污染带来的严峻挑战,膜分离和伤口敷料。包括详细的机械见解和防污水凝胶的明智选择,旨在确定必须弥合的现有差距,以满足实际要求,同时解决长期防污应用。
    Biofouling remains a persistent challenge within the domains of biomedicine, tissue engineering, marine industry, and membrane separation processes. Multifunctional hydrogels have garnered substantial attention due to their complex three-dimensional architecture, hydrophilicity, biocompatibility, and flexibility. These hydrogels have shown notable advances across various engineering disciplines. The antifouling efficacy of hydrogels typically covers a range of strategies to mitigate or inhibit the adhesion of particulate matter, biological entities, or extraneous pollutants onto their external or internal surfaces. This review provides a comprehensive review of the antifouling properties and applications of hydrogels. We first focus on elucidating the fundamental principles for the inherent resistance of hydrogels to fouling. This is followed by a comprehensive investigation of the methods employed to enhance the antifouling properties enabled by the hydrogels\' composition, network structure, conductivity, photothermal properties, release of reactive oxygen species (ROS), and incorporation of silicon and fluorine compounds. Additionally, we explore the emerging prospects of antifouling hydrogels to alleviate the severe challenges posed by surface contamination, membrane separation and wound dressings. The inclusion of detailed mechanistic insights and the judicious selection of antifouling hydrogels are geared toward identifying extant gaps that must be bridged to meet practical requisites while concurrently addressing long-term antifouling applications.
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  • 文章类型: Review
    蛋白质对人类健康至关重要,具有巨大的食品应用。尽管他们的优势,植物和动物蛋白通常由于氢键而表现出有限的分子灵活性和较差的溶解度,疏水相互作用,以及它们分子结构中的离子相互作用。因此,迫切需要修饰蛋白质的刚性结构以增强其稳定性和功能特性。超声辅助离子液体(UA-IL)处理用于开发化合物修饰并生产具有优异功能特性的蛋白质已受到关注。然而,没有评论专门讨论UA-IL和蛋白质之间的相互作用。因此,这篇综述集中在有关UA-IL对物理化学性质的影响和潜在反应机理的最新研究进展(包括粒径;次要,和三级结构;和表面形态)以及功能(如溶解度,乳化性能,和起泡能力)的蛋白质。此外,还从不同角度讨论了修饰蛋白的安全性评估,如急性和慢性毒性,遗传毒性,细胞毒性,以及环境和微生物毒性。本综述证明UA-IL处理诱导的蛋白质结构变化显著影响蛋白质的功能特性。这种处理方法通过空化有效促进蛋白质结构拉伸和空间重排,热效应,和离子相互作用。因此,修饰蛋白的功能特性表现出明显的增强,从而为在食品工业中利用修饰的蛋白质产品带来了更多的机会。还提出了使用UA-IL进行蛋白质修饰的潜在未来方向。
    Proteins are essential to human health with enormous food applications. Despite their advantages, plant and animal proteins often exhibit limited molecular flexibility and poor solubility due to hydrogen bonds, hydrophobic interactions, and ionic interactions within their molecular structures. Thus, there is an urgent need to modify the rigid structure of proteins to enhance their stability and functional properties. Ultrasound-assisted ionic liquid (UA-IL) treatment for developing compound modification and producing proteins with excellent functional properties has received interest. However, no review specifically addresses the interactions between UA-ILs and proteins. Hence, this review focused on recent research advancements concerning the effects and potential reaction mechanisms of UA-ILs on the physicochemical properties (including particle size; primary, secondary, and tertiary structure; and surface morphology) as well as the functionality (such as solubility, emulsifying properties, and foaming ability) of proteins. Moreover, the safety evaluation of modified proteins was also discussed from various perspectives, such as acute and chronic toxicity, genotoxicity, cytotoxicity, and environmental and microbial toxicity. This review demonstrated that UA-IL treatment-induced protein structural changes significantly impact the functional characteristics of proteins. This treatment approach efficiently promotes protein structure stretching and spatial rearrangement through cavitation, thermal effects, and ionic interactions. As a result, the functional properties of modified proteins exhibited an obvious enhancement, thereby bringing more opportunities to utilize modified protein products in the food industry. Potential future directions for protein modification using UA-ILs were also proposed.
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  • 文章类型: Review
    在一个快速增长的世界里,石油广泛应用于各行各业,和提取,processing,石油的运输会产生大量的含石油废水。常规的油/水分离方法通常是无效且昂贵的。基于纳米纤维素的气凝胶(NA)已经成为该问题的可能解决方案。然而,为了有效地用于油/水分离,需要疏水改性。本文对这些过程中常用的材料进行了综述,并概述了对吸附剂材料的要求以及创建独特亲脂性表面的方法。还讨论了NA疏水化方法的新趋势。此外,它包括开发复合纳米纤维素气凝胶(CNAs)和纤维素基膜,专门开发用于油/水(o/w)分离,考虑到不同的分离要求。该分析还检查了CNA如何通过引入促进油收集或使吸附剂可回收的特殊性质而演变。我们还讨论了在不断变化的社会中为这些重要应用创建有效的NA的困难,以及创建溢油清理设备的困难。
    In a rapidly growing world, petroleum is used extensively in various industries, and the extraction, processing, and transportation of petroleum generates large amounts of petroleum-containing wastewater. Conventional oil/water separation methodologies are often ineffective and costly. Nanocellulose-based aerogels (NA) have emerged as a possible solution to this problem. However, hydrophobic modification is required for effective use in oil/water separation. This review on materials commonly used in these processes and outlines the requirements for adsorbent materials and methods for creating unique lipophilic surfaces. New trends in hydrophobization methods for NA are also discussed. Additionally, it includes the development of composite nanocellulose aerogels (CNAs) and cellulose based membrane specially developed for oil/water (o/w) separation considering different separation requirements. This analysis also examines how CNAs have evolved by introducing special properties that facilitate oil collection or make the adsorbent recyclable. We also discuss the difficulties in creating effective NAs for these important applications in a changing society, as well as the difficulties in creating oil recovery equipment for oil spill cleanup.
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  • 文章类型: Journal Article
    胆汁酸在人体中起着重要的作用,并且它们的库的变化可以用作各种肝脏病理的标记。除了它们在调节炎症反应和细胞生存能力方面的功能作用外,非共轭或共轭,次要,或胆汁酸的主要性质解释了它们的各种配体效应。常见的亲水性胆汁酸已成功用作局部治疗,以解决药物引起的细胞损伤或改善听力损失。从各种文献参考中,胆汁酸显示浓度和组织依赖性效应。一些疏水性胆汁酸作为配体调节维生素D受体,毒蕈碱受体,钙激活钾通道,内耳系统中的重要蛋白质。目前,研究胆汁酸对听力损失的治疗作用的资源有限,关于在远耳系统中检测胆汁酸的信息很少甚至没有,更不用说基线胆汁酸水平及其在健康和疾病条件下的患病率。这篇综述介绍了亲水性和疏水性人胆汁酸及其在调节细胞完整性方面的组织特异性作用。因此考虑胆汁酸对内耳组织的可能影响和扩展的治疗适用性。
    Bile acids play important roles in the human body, and changes in their pool can be used as markers for various liver pathologies. In addition to their functional effects in modulating inflammatory responses and cellular survivability, the unconjugated or conjugated, secondary, or primary nature of bile acids accounts for their various ligand effects. The common hydrophilic bile acids have been used successfully as local treatment to resolve drug-induced cell damage or to ameliorate hearing loss. From various literature references, bile acids show concentration and tissue-dependent effects. Some hydrophobic bile acids act as ligands modulating vitamin D receptors, muscarinic receptors, and calcium-activated potassium channels, important proteins in the inner ear system. Currently, there are limited resources investigating the therapeutic effects of bile acid on hearing loss and little to no information on detecting bile acids in the remote ear system, let alone baseline bile acid levels and their prevalence in healthy and disease conditions. This review presents both hydrophilic and hydrophobic human bile acids and their tissue-specific effects in modulating cellular integrity, thus considering the possible effects and extended therapeutic applicability of bile acids to the inner ear tissue.
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  • 文章类型: Journal Article
    生物工程和医疗设备的最新进展受到合成聚合物的极大影响和支配,特别是聚氨酯(PU)。PU提供可定制的机械性能和长期稳定性,但是它们固有的疏水性在实际上的生物应用过程中提出了挑战,如界面高摩擦,强蛋白质吸附,和血栓形成。为了解决这些问题,用于生成功能亲水层的PU的表面改性受到了广泛的关注,但由于不可逆的机械磨损或生物降解,产生的表面功能性的耐久性较差。因此,许多研究人员已经研究了批量改性技术,以将两性离子聚合物或基团结合到PU的主链或侧链上,从而提高其亲水性和生物相容性。这篇全面的综述对著名的两性离子PU(ZPU)进行了广泛的概述,包括那些基于磷酸胆碱的,磺基甜菜碱,和羧基甜菜碱.这篇综述探讨了它们广泛的生物医学应用,从血液接触装置到抗菌涂层,防污海洋涂料,分离膜,润滑表面,和形状记忆和自我修复材料。最后,综述了ZPU在生物应用中的挑战和未来前景。
    Recent advancements in bioengineering and medical devices have been greatly influenced and dominated by synthetic polymers, particularly polyurethanes (PUs). PUs offer customizable mechanical properties and long-term stability, but their inherent hydrophobic nature poses challenges in practically biological application processes, such as interface high friction, strong protein adsorption, and thrombosis. To address these issues, surface modifications of PUs for generating functionally hydrophilic layers have received widespread attention, but the durability of generated surface functionality is poor due to irreversible mechanical wear or biodegradation. As a result, numerous researchers have investigated bulk modification techniques to incorporate zwitterionic polymers or groups onto the main or side chains of PUs, thereby improving their hydrophilicity and biocompatibility. This comprehensive review presents an extensive overview of notable zwitterionic PUs (ZPUs), including those based on phosphorylcholine, sulfobetaine, and carboxybetaine. The review explores their wide range of biomedical applications, from blood-contacting devices to antibacterial coatings, fouling-resistant marine coatings, separation membranes, lubricated surfaces, and shape memory and self-healing materials. Lastly, the review summarizes the challenges and future prospects of ZPUs in biological applications.
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  • 现有的和新的药物分子的最常见的缺点是它们的低生物利用度,因为它们的低溶解度。在肠内途径中提高亲水性差的分子的生物利用度的最重要方法之一是无定形固体分散体(ASD)。由于在配制过程中产生的自由能的可用性,无定形形式的化合物的溶解度相对较高。该自由能导致所制备的ASD的结晶性质变为稳定的结晶形式,导致产物的溶解度降低。由于固有的化学和物理不确定性以及关于活性分子与载体相互作用的有限知识,这个ASD是一项具有挑战性的任务。这篇综述侧重于通过考虑解释自由能概念的各种理论来稳定ASD的策略,物理相互作用,和热性能。这篇综述还强调了分子建模和机器学习计算进步以稳定ASD。
    The most common drawback of the existing and novel drug molecules is their low bioavailability because of their low solubility. One of the most important approaches to enhance the bioavailability in the enteral route for poorly hydrophilic molecules is amorphous solid dispersion (ASD). The solubility of compounds in amorphous form is comparatively high because of the availability of free energy produced during formulation. This free energy results in the change of crystalline nature of the prepared ASD to the stable crystalline form leading to the reduced solubility of the product. Due to the intrinsic chemical and physical uncertainty and the restricted knowledge about the interactions of active molecules with the carriers making, this ASD is a challenging task. This review focused on strategies to stabilize ASD by considering the various theories explaining the free-energy concept, physical interactions, and thermal properties. This review also highlighted molecular modeling and machine learning computational advancement to stabilize ASD.
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