边缘功能化石墨烯量子点作为同时检测葡萄糖、半乳糖和乳糖的纳米生物传感器

IF 5.3 2区 化学 Q2 CHEMISTRY, PHYSICAL Journal of Molecular Liquids Pub Date : 2024-09-16 DOI:10.1016/j.molliq.2024.126044
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引用次数: 0

摘要

迅速准确地诊断疾病,尤其是糖尿病,仍然是医疗保健领域一个紧迫而重要的问题。监测血糖水平是糖尿病患者有效控制病情的当务之急。为满足这一需要,开发非侵入式同步糖类检测设备大有可为。在本文中,我们介绍了一种新型纳米生物传感器的设计,该传感器采用边缘功能化石墨烯量子点,可同时检测三种关键糖类:葡萄糖、半乳糖和乳糖。通过全面的分子动力学模拟,我们证明了所提出的生物传感器的可行性和稳定性。我们的结果表明,石墨烯量子点的边缘功能化显著增强了其结合亲和力,计算得出的葡萄糖平均接触次数为 2174 次,半乳糖平均接触次数为 1085 次,乳糖平均接触次数为 6274 次。此外,径向分布函数分析与这些发现相吻合,突出显示了乳糖与生物传感器的明显相互作用,其次是葡萄糖,然后是半乳糖。详细的分析表明,纳米生物传感器表面的糖类结合明显且不重叠,其中乳糖的亲和力和相互作用强度最高,其次是葡萄糖和半乳糖。这一创新方法标志着生物传感器技术向前迈出了一大步,为精确、可靠地监测糖尿病患者的血糖水平提供了潜在的途径。
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Edge-functionalized graphene quantum dot as a nano-biosensor for simultaneous detection of glucose, galactose and lactose

The swift and accurate diagnosis of diseases, particularly diabetes, remains a pressing and critical concern in healthcare. Monitoring blood glucose levels is imperative for diabetic patients to manage their condition effectively. Addressing this necessity, developing non-invasive, simultaneous detection devices for sugars shows immense promise. Herein, we introduce the design of a novel nano-biosensor employing edge‐functionalized graphene quantum dots, enabling the concurrent detection of three pivotal sugars: glucose, galactose, and lactose. Through comprehensive molecular dynamics simulations, we demonstrate the feasibility and stability of the proposed biosensor. Our results show that the edge-functionalization of graphene quantum dots significantly enhances their binding affinity, with calculated average number of contacts of 2174 for glucose, 1085 for galactose, and 6274 for lactose. Furthermore, the radial distribution function analysis echoed these findings, highlighting lactose’s pronounced interaction with the biosensor, followed by glucose and then galactose. The detailed analysis reveals distinct and non-overlapping sugar bindings on the nano-biosensor surface, with lactose showing the highest affinity and interaction strength, followed by glucose and galactose. This innovative approach marks a significant stride forward in biosensor technology, providing a potential avenue for precise and dependable monitoring of blood sugar levels in diabetic patients.

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来源期刊
Journal of Molecular Liquids
Journal of Molecular Liquids 化学-物理:原子、分子和化学物理
CiteScore
10.30
自引率
16.70%
发文量
2597
审稿时长
78 days
期刊介绍: The journal includes papers in the following areas: – Simple organic liquids and mixtures – Ionic liquids – Surfactant solutions (including micelles and vesicles) and liquid interfaces – Colloidal solutions and nanoparticles – Thermotropic and lyotropic liquid crystals – Ferrofluids – Water, aqueous solutions and other hydrogen-bonded liquids – Lubricants, polymer solutions and melts – Molten metals and salts – Phase transitions and critical phenomena in liquids and confined fluids – Self assembly in complex liquids.– Biomolecules in solution The emphasis is on the molecular (or microscopic) understanding of particular liquids or liquid systems, especially concerning structure, dynamics and intermolecular forces. The experimental techniques used may include: – Conventional spectroscopy (mid-IR and far-IR, Raman, NMR, etc.) – Non-linear optics and time resolved spectroscopy (psec, fsec, asec, ISRS, etc.) – Light scattering (Rayleigh, Brillouin, PCS, etc.) – Dielectric relaxation – X-ray and neutron scattering and diffraction. Experimental studies, computer simulations (MD or MC) and analytical theory will be considered for publication; papers just reporting experimental results that do not contribute to the understanding of the fundamentals of molecular and ionic liquids will not be accepted. Only papers of a non-routine nature and advancing the field will be considered for publication.
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