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Antiviral drug carriers for human immunodeficiency virus 人类免疫缺陷病毒的抗病毒药物载体
Pub Date : 2023-10-28 DOI: 10.1016/j.nwnano.2023.100027
Jiahui Wang, Ning Guo, Weiliang Hou

Human immunodeficiency virus (HIV) has become one of the greatest public health problems threatening human health. HIV treatment presents a certain limit due to the complexity of the infection cycle and the low therapeutic target. New viral drug treatments should be developed for ameliorating the potentially toxic side effects and drug resistance. Nanomaterials with strong solubility and bioavailability show obvious merit in drug delivery, which can be an effective assistant to treat HIV. Herein, various novel nanomaterials were reviewed for drug delivery, including lipid nanoparticles, polymeric nanoparticles, metal nanoparticles, micelles, etc. We also discussed the advantages and the limitations of novel nanocarriers for HIV prevention, diagnosis and treatment and prospected potential materials for HIV.

人类免疫缺陷病毒(HIV)已成为威胁人类健康的最大公共卫生问题之一。由于感染周期的复杂性和较低的治疗靶标,HIV的治疗存在一定的局限性。应该开发新的病毒药物治疗方法,以改善潜在的毒副作用和耐药性。纳米材料具有很强的溶解度和生物利用度,在给药方面具有明显的优势,可作为治疗HIV的有效辅助药物。本文综述了用于药物传递的各种新型纳米材料,包括脂质纳米颗粒、聚合物纳米颗粒、金属纳米颗粒、胶束等。我们还讨论了新型纳米载体在艾滋病预防、诊断和治疗方面的优势和局限性,并展望了潜在的艾滋病材料。
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引用次数: 0
Visible-light-driven photocatalysis for the sustainable synthesis of (±)-pregabalin using carbon nitride from melamine-cyanuric acid complex 三聚氰胺-氰尿酸复合物中氮化碳的可见光催化可持续合成(±)-普瑞巴林
Pub Date : 2023-10-11 DOI: 10.1016/j.nwnano.2023.100026
Sumin Kim , Hyunwoo Choi , Minjoon Kwak , Youngran Seo , Dongwon Yoo

The pharmaceutical industry has long sought efficient and environmentally sustainable methods for the synthesis of pharmaceutically significant molecules, particularly potent γ-amino butyric acid (GABA) derivatives. Photocatalysis has emerged as a promising approach, offering mild reaction conditions and utilizing renewable energy sources. In this study, we present a novel and sustainable photocatalytic strategy for the synthesis of (±)-pregabalin, a valuable GABA derivative, using carbon nitride derived from the complex of melamine and cyanuric acid (CN-MC) as the catalyst. Under visible light irradiation, CN-MC demonstrated outstanding photocatalytic performance, achieving an excellent 99% yield in the visible-light-driven decarboxylative radical conjugate addition. The formed β-substituted γ-lactam intermediate serves as a crucial building block for the synthesis of (±)-pregabalin. Moreover, the recyclability and scalability of CN-MC as a photocatalyst enhance the process's eco-friendliness, making it an appealing option for large-scale pharmaceutical synthesis.

制药行业长期以来一直在寻求有效和环境可持续的方法来合成具有药用价值的分子,特别是强效的γ-氨基丁酸(GABA)衍生物。光催化已经成为一种很有前途的方法,提供温和的反应条件并利用可再生能源。在本研究中,我们提出了一种新的、可持续的光催化策略,以三聚氰胺和氰尿酸(CN-MC)复合物衍生的氮化碳为催化剂,合成(±)-普瑞巴林,这是一种有价值的GABA衍生物。在可见光照射下,CN-MC表现出优异的光催化性能,在可见光驱动的脱羧自由基共轭加成中实现了99%的优异产率。形成的β-取代的γ-内酰胺中间体是合成(±)-普瑞巴林的关键组成部分。此外,CN-MC作为光催化剂的可回收性和可扩展性增强了该工艺的生态友好性,使其成为大规模药物合成的一种有吸引力的选择。
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引用次数: 0
A perspective on the synergistic use of 3D printing and electrospinning to improve nanomaterials for biomedical applications 3D打印和静电纺丝协同使用改善生物医学应用纳米材料的前景
Pub Date : 2023-10-09 DOI: 10.1016/j.nwnano.2023.100025
Ovinuchi Ejiohuo

3D printing and electrospinning are used to fabricate complex structures with improved properties. Combining 3D printing and electrospinning potentially creates composite structures with even superior properties for biomedical applications. However, there is limited research, use, and literature on this synergy. While 3D printing is used extensively in the biomedical and pharmaceutical industries, the 3D printed polymer strength can be limited due to the high cooling rate during the printing process, resulting in a lack of crystallinity. Additives such as crosslinkers and reinforcements such as particles, nanomaterials, and fibers are often incorporated into the polymer melt to improve its properties. One promising reinforcement is electrospun nanofibers, which have high aspect ratios, specific surface area, and porosity. However, electrospinning can result in variability in fiber size and morphology.

Further research is needed to optimize the technique and improve its reproducibility. This perspective provides an assessment of this synergistic technology. This study explores the potential for biomedical applications while offering opinions on the most recent research combining 3D printing and electrospinning. The fact that effective 3D printing and electrospinning integration can generate a powerful platform to develop nanomaterials with superstructures highlights the high significance of this perspective.

3D打印和静电纺丝用于制造具有改进性能的复杂结构。将3D打印和静电纺丝相结合,有可能为生物医学应用创造出性能更优越的复合材料结构。然而,关于这种协同作用的研究、使用和文献有限。虽然3D打印在生物医学和制药行业中广泛使用,但由于打印过程中的高冷却速率,3D打印的聚合物强度可能受到限制,导致结晶度不足。添加剂,如交联剂和增强剂,如颗粒、纳米材料和纤维,通常被掺入聚合物熔体中以提高其性能。一种有前途的增强材料是电纺纳米纤维,它具有高的长径比、比表面积和孔隙率。然而,静电纺丝会导致纤维尺寸和形态的变化。需要进一步的研究来优化该技术并提高其再现性。这一观点提供了对这种协同技术的评估。这项研究探索了生物医学应用的潜力,同时对3D打印和静电纺丝相结合的最新研究发表了意见。有效的3D打印和静电纺丝集成可以产生一个强大的平台来开发具有超结构的纳米材料,这一事实突显了这一观点的高度重要性。
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引用次数: 0
Electrochemical epitaxy of nanostructures 纳米结构的电化学外延
Pub Date : 2023-10-03 DOI: 10.1016/j.nwnano.2023.100024
Yuwei Guo , Yang Hu , Jian Shi

Epitaxy of nanostructured materials is a critical step in developing functional nanodevices. Electrochemical epitaxy has been shown robust and low-cost in advancing the deployment of nanomaterials. This paper offers a brief review on a wide category of nanostructured materials and phases synthesized via electrochemical epitaxy approaches over the past several decades. The review highlights the advantages of electrochemical approach over other high-temperature, high-vacuum technologies in terms of accessibility to target materials’ phases, morphologies and yield. Electrochemical epitaxy's extraordinary ability in enabling certain valence states which cannot be reached at vacuum condition could bring new concepts in developing a plethora of metastable functional materials. It also gives an overview on possible growth modes and mechanisms that may be employed in developing emerging materials and phases.

纳米结构材料的外延是开发功能性纳米器件的关键步骤。电化学外延在推进纳米材料部署方面已显示出稳健和低成本。本文简要回顾了过去几十年来通过电化学外延方法合成的一大类纳米结构材料和相。该综述强调了电化学方法在可接近目标材料的相、形态和产率方面优于其他高温、高真空技术。电化学外延在实现某些在真空条件下无法达到的价态方面的非凡能力,可能会为开发过多的亚稳态功能材料带来新的概念。它还概述了可能用于开发新兴材料和阶段的生长模式和机制。
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引用次数: 0
Photocatalytic H2O2 production in controlled oxidative environments using covalent triazine frameworks 使用共价三嗪框架在受控氧化环境中光催化产生H2O2
Pub Date : 2023-09-27 DOI: 10.1016/j.nwnano.2023.100023
Sunil Kumar , Bolormaa Bayarkhuu , Hyorin Ahn , Hyekyung Cho , Jeehye Byun

An emerging sustainable technology for the photocatalytic synthesis of hydrogen peroxide (H2O2) from molecular oxygen and sunlight has garnered significant research interest. The addition of sacrificial agents often enhances O2 reduction for H2O2 production but also results in the accumulation of their oxidized impurities in the reaction media. Exploring photo-oxidative reaction designs, therefore, is critical to improving photocatalytic H2O2 production. Herein, we report that controlling oxidative reaction media makes a significant difference in photocatalytic H2O2 production. The challenging toluene oxidation could be integrated with photocatalytic O2 reduction, co-producing H2O2 as well as benzaldehyde. Covalent triazine frameworks (CTFs) were selected as platform photocatalysts, where the CTF with a thiophene linker exhibited a high H2O2 production (105 µmol) with toluene oxidation under simulated sunlight, which was 4.7- and 2.5-fold higher than that observed with H2O (22.3 µmol) and H2O/alcohol (42.4 µmol) oxidation, respectively. The theoretical calculation reveals that the binding affinities of toluene and O2 on CTF surfaces enable the simultaneous production of benzaldehyde and H2O2, respectively. A dual-phase system composed of toluene and water layers allows simple separation of the two products with high purity. Our finding demonstrates the crucial influence of oxidative environments in photocatalytic O2 reduction, showing the potential of toluene photo-oxidation as a cooperative reaction medium for H2O2 production.

利用分子氧和阳光光催化合成过氧化氢(H2O2)的一种新兴的可持续技术引起了人们的极大兴趣。牺牲剂的添加通常增强了H2O2生产的O2还原,但也导致其氧化杂质在反应介质中的积累。因此,探索光氧化反应设计对于提高光催化H2O2的生产至关重要。在此,我们报道了控制氧化反应介质在光催化H2O2生产中产生显著差异。具有挑战性的甲苯氧化可以与光催化O2还原相结合,共同产生H2O2和苯甲醛。选择共价三嗪骨架(CTF)作为平台光催化剂,其中具有噻吩连接体的CTF在模拟阳光下甲苯氧化时表现出高H2O2产量(105µmol),分别是H2O(22.3µmol)和H2O/醇(42.4µmol)氧化时的4.7倍和2.5倍。理论计算表明,甲苯和O2在CTF表面的结合亲和力分别使苯甲醛和H2O2能够同时产生。由甲苯和水层组成的双相系统允许以高纯度简单地分离两种产物。我们的发现证明了氧化环境对光催化O2还原的关键影响,显示了甲苯光氧化作为H2O2生产的协同反应介质的潜力。
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引用次数: 0
Review on MnCo2S4-based composite materials for supercapacitors 超级电容器用MnCo2S4基复合材料研究进展
Pub Date : 2023-09-26 DOI: 10.1016/j.nwnano.2023.100022
Shamali S. Rendale , Abhishek A. Kulkarni , Hemraj M. Yadav , Kiran Kumar K. Sharma , Tejasvinee S. Bhat

Manganese-cobalt sulfide (MnCo2S4) based materials have shown immense potential in the field of energy storage which can be attributed to the high theoretical capacitance, cost-effectiveness, abundance, and feasibility in the synthesis. The present review is mainly classified into two categories of electrode materials: the pristine MnCo2S4 and the composites of MnCo2S4. Over the years, there have been numerous reports on this topic also comprised different experimentations. This report mainly reviews the advances that have taken place over time in MnCo2S4-based electrode materials alongside studying the effects of the morphology and the constituents of MnCo2S4. Moreover, the MnCo2S4 composites show higher performances than the pristine MnCo2S4, including a higher delivery of capacitance, energy density, and power density. Although the interest in this topic is constantly increasing, there is ample scope for the development of MnCo2S4-based materials on a large scale. The review also provides the current shortcomings in our observation and the possible solutions to overcome them.

硫化锰钴(MnCo2S4)基材料在储能领域显示出巨大的潜力,这可归因于其高理论电容、成本效益、丰度和合成的可行性。目前的综述主要分为两类电极材料:原始MnCo2S4和MnCo2S4。多年来,有许多关于这个主题的报道,也包括不同的实验。本报告主要综述了MnCo2S4基电极材料随着时间的推移所取得的进展,同时研究了MnCo2S4的形态和成分的影响。此外,MnCo2S4复合材料显示出比原始MnCo2S4-更高的性能,包括更高的电容、能量密度和功率密度。尽管人们对这一主题的兴趣不断增加,但大规模开发MnCo2S4基材料仍有很大的空间。审查还提供了我们观察中目前存在的不足以及克服这些不足的可能解决方案。
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引用次数: 2
A first-principles investigation on the structural, stability and mechanical properties of novel Ag, Au and Cu-graphdiyne magnetic semiconducting monolayers 新型Ag、Au和Cu石墨烯磁性半导体单层结构、稳定性和力学性能的第一性原理研究
Pub Date : 2023-09-24 DOI: 10.1016/j.nwnano.2023.100021
Bohayra Mortazavi , Fazel Shojaei , Xiaoying Zhuang

Most recently, silver-metalated graphdiyne (GDY) nanomembranes have been fabricated using the wet-chemistry approach, with highly efficient response for light-driven decomposition of antibiotics (ACS Appl. Nano Mater. 2023, 6, 7395). Inspired by this exciting advance, herein for the first time we theoretically explore the key physical properties of the single-layer M-(N)GDY (M=Cu, Ag, Au) monolayers. Spin-polarized density functional theory (DFT) results reveal that metalated GDY monolayers favor a high-spin ground state, presenting a magnetic moment of 3 µB/unitcell. The sheets are characterized as small band gap magnetic semiconductors, ranging between 0.112 and 0.960 eV, in which only one spin contributes to the band gap. Ab-initio molecular dynamics results confirm the remarkable thermal stability of the constructed graphdiyne nanomembranes at 1000 K. The dynamical stability and mechanical properties at the ground state are furthermore investigated using machine learning interatomic potentials. The ultimate tensile strengths of the metalated graphdiyne lattices are found to be decent, over 6 GPa close to the ground state, but a few folds lower than the native metal-free counterparts. The presented first-principles results confirm remarkable thermal, dynamical and mechanical stability, and appealing electronic characteristics of the metalated graphdiyne nanosheets, attractive to design advanced light-weight energy storage/conversion and spintronic nanosystems.

最近,已经使用湿化学方法制备了金属化银石墨烯(GDY)纳米膜,其对抗生素的光驱动分解具有高效响应(ACS Appl.Nano-Mater.2023,67395)。受这一令人兴奋的进展的启发,本文首次从理论上探索了单层M-(N)GDY(M=Cu,Ag,Au)单层的关键物理性质。自旋极化密度泛函理论(DFT)结果表明,金属化的GDY单层有利于高自旋基态,呈现3µB/晶胞的磁矩。这些片的特征是小带隙磁性半导体,范围在0.112到0.960eV之间,其中只有一个自旋对带隙有贡献。从头算分子动力学结果证实了所构建的石墨烯纳米膜在1000K下的显著热稳定性。利用机器学习原子间势进一步研究了基态的动力学稳定性和力学性质。发现金属化石墨烯晶格的极限拉伸强度相当不错,接近基态超过6GPa,但比天然无金属晶格低几倍。所提出的第一性原理结果证实了金属化石墨烯纳米片显著的热稳定性、动力学和机械稳定性以及吸引人的电子特性,对设计先进的轻质储能/转换和自旋电子纳米系统具有吸引力。
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引用次数: 0
Electronic structures and properties of lead-free cesium- or rubidium-based perovskite halide compounds by first-principles calculations 用第一性原理计算无铅铯基或铷基钙钛矿卤化物的电子结构和性质
Pub Date : 2023-09-16 DOI: 10.1016/j.nwnano.2023.100020
Riku Okumura, Takeo Oku, Atsushi Suzuki

Perovskite halide compounds are expected to provide various applications such as solar cells and light-emitting diodes. In the present work, structure models of ABX3 (A = Rb, or Cs, B = Sn, Sr, or Ca, X = Cl, Br, or I) perovskite crystals were constructed, and the electronic structures and properties were analyzed by the first-principles calculations. It was found that halogen substitutions affected the energy gaps, and carrier mobilities of these perovskite crystals, and that the Sn-based perovskite crystals were predicted to have relatively low total energies and excellent carrier mobility. It was also found that the calculated total energies in this study are closely related with the tolerance factors, and the total energies decreased as the tolerance factors approach 1.

钙钛矿卤化物有望提供各种应用,例如太阳能电池和发光二极管。本工作构建了ABX3(A=Rb,或Cs,B=Sn,Sr,或Ca,X=Cl,Br,或I)钙钛矿晶体的结构模型,并通过第一性原理计算分析了其电子结构和性质。研究发现,卤素取代影响了这些钙钛矿晶体的能隙和载流子迁移率,并且预测Sn基钙钛矿晶体具有相对较低的总能量和优异的载流子迁移率。研究还发现,本研究中计算的总能量与容差因子密切相关,并且总能量随着容差因子接近1而降低。
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引用次数: 1
Recent trends in metal-doped carbon nitride-catalyzed heterogeneous light-driven organic transformations 金属掺杂氮化碳催化非均相光驱动有机转化的最新趋势
Pub Date : 2023-09-09 DOI: 10.1016/j.nwnano.2023.100019
Pengfei Zhou , Qian Yang , Yurong Tang , Yunfei Cai

Doping carbon nitride with metal nanoparticles and metal single atoms is an efficient way to enhance the photocatalytic activity of the material for light-driven synthetic transformations. The metal-doped carbon nitride composites have also been recently demonstrated as one of the most powerful and sustainable metallaphotocatalysts in organic synthesis. A series of metals such as Pd, Ni, Cu, Fe, Co, and others have been incorporated into carbon nitride and used in photocatalytic reactions, such as cross-couplings, reductions, oxygenations, etc. These newly developed heterogeneous photocatalytic systems exhibit inherent advantages of easy separation and remarkable recyclability. In this review, we summarize the emergence, recent development, as well as unexplored aspects of the metal-doped carbon nitride in the heterogeneous photocatalytic organic transformations.

用金属纳米颗粒和金属单原子掺杂氮化碳是提高光驱动合成转化材料光催化活性的有效方法。金属掺杂的氮化碳复合材料最近也被证明是有机合成中最强大和最可持续的金属光催化剂之一。Pd、Ni、Cu、Fe、Co等一系列金属已被掺入氮化碳中,并用于光催化反应,如交叉偶联、还原、氧化等。这些新开发的多相光催化系统具有易于分离和显著可回收的固有优势。在这篇综述中,我们总结了金属掺杂氮化碳在非均相光催化有机转化中的出现、最新发展以及未探索的方面。
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引用次数: 0
Research of graphdiyne materials applied for electrochemical energy storage 石墨烯材料在电化学储能中的应用研究
Pub Date : 2023-09-04 DOI: 10.1016/j.nwnano.2023.100017
Deyi Zhang , Xiaodong Li , Wenjing Liu , Jingchi Gao , Xingru Yan , Qin Liu , Changshui Huang

In recent decades, as the world has grappled with the twin challenges of environmental degradation and energy scarcity, the search for sustainable, efficient, and environmentally sound energy technologies has become more urgent than ever. Interest in carbon-based materials has surged in recent years because they are environmentally friendly, abundant, and chemically stable. As an emerging carbon allotrope, graphdiyne (GDY) is a promising candidate for next-generation energy devices due to its unique chemical structure, natural porosity (the pore diameter is 0.542 nm and the layer spacing is 0.365 nm), high conjugation, amazing charge mobility, excellent conductivity, and excellent stability. Here we reviewed the applications of GDY and its derivatives in electrochemical energy storage have been reviewed, including intrinsic GDY (GDY film, GDY with different aggregated morphologies, such as nanotubes, nanowires, and nanostrips), heteroatom doped GDY, GDY composite, and GDY derivates. The preparation strategies of those GDY-based materials and their performances applied in the electrochemical energy storage devices have been compared and discussed. GDY has been reported extensively to show great potential in various energy storage devices including lithium-ion batteries (LIBs), sodium-ion batteries (SIBs), and potassium-ion batteries (KIBs), of which the theoretical capacities are up to 2553 (LIBs), 2006 (SIBs), 1600 (KIBs) mAh/g, respectively. This review covers the latest developments, challenges and prospects of GDY based materials for the applications of various energy storage fields. Hopefully, this paper can provide valuable insights for the research of GDY and related carbon materials in electrochemical energy storage and promote the application of carbon materials.

近几十年来,随着世界应对环境退化和能源短缺的双重挑战,寻找可持续、高效和无害环境的能源技术变得比以往任何时候都更加紧迫。近年来,人们对碳基材料的兴趣激增,因为它们对环境友好、储量丰富且化学稳定。石墨烯(GDY)作为一种新兴的碳同素异形体,由于其独特的化学结构、天然的孔隙率(孔径为0.542nm,层间距为0.365nm)、高共轭性、惊人的电荷迁移率、优异的导电性和优异的稳定性,是下一代能源器件的候选材料。本文综述了GDY及其衍生物在电化学储能中的应用,包括本征GDY(GDY膜,具有不同聚集形态的GDY,如纳米管、纳米线和纳米片)、杂原子掺杂的GDY、GDY复合材料和GDY衍生物。对这些GDY基材料的制备策略及其在电化学储能器件中的应用性能进行了比较和讨论。GDY已被广泛报道在包括锂离子电池(LIBs)、钠离子电池(SIBs)和钾离子电池(KIBs)在内的各种储能装置中显示出巨大的潜力,其中理论容量分别高达2553(LIBs)、2006(SIBs)和1600(KIBs)mAh/g。本文综述了GDY基材料在各种储能领域的最新发展、挑战和前景。希望本文能为GDY及相关碳材料在电化学储能中的研究提供有价值的见解,促进碳材料的应用。
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引用次数: 0
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