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Keywords = single-molecule electronic techniques

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32 pages, 10527 KB  
Review
Single-Molecule Conductance of Non-Redox Proteins: Mechanisms, Measurements, and Applications
by Zhimin Fan, Miao Chen, Jie Xiang and Bintian Zhang
Biomolecules 2026, 16(4), 495; https://doi.org/10.3390/biom16040495 - 25 Mar 2026
Viewed by 564
Abstract
Charge transport underpins essential biological processes, including cellular respiration, photosynthesis, and enzymatic catalysis. Advances in molecular electronics have enabled single-molecule measurements that unequivocally establish redox-active proteins as efficient electron conductors, with their metal cofactors serving as intrinsic redox relays. By contrast, ubiquitous non-redox [...] Read more.
Charge transport underpins essential biological processes, including cellular respiration, photosynthesis, and enzymatic catalysis. Advances in molecular electronics have enabled single-molecule measurements that unequivocally establish redox-active proteins as efficient electron conductors, with their metal cofactors serving as intrinsic redox relays. By contrast, ubiquitous non-redox proteins lacking such redox centers have long been considered poor conductors. However, recent research has challenged this view, demonstrating that efficient charge transport in non-redox proteins can be mediated through polypeptide backbones, aromatic side-chain arrays, and hydrogen bond networks. This review surveys progress in understanding the single-molecule conductance of non-redox proteins. Firstly, we elucidate the fundamental transport mechanisms, highlighting the interplay between coherent tunneling and thermally activated hopping. We then provide an overview of state-of-the-art experimental techniques for single-molecule characterization. Through analysis of diverse systems spanning short peptides to large enzymes, we illustrate how aromatic amino acid networks and dynamic conformational fluctuations govern conductance, enabling emerging applications in label-free biosensing and single-molecule protein/DNA sequencing. Finally, we discuss persistent challenges and outline future opportunities for integrating protein-based conductors into bioelectronic devices. This review aims to stimulate further research and pave the way for novel applications harnessing protein conductance. Full article
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13 pages, 4761 KB  
Article
Low Molecular Weight Acid-Modified Aluminum Nitride Powders for Enhanced Hydrolysis Resistance
by Linguang Wu, Yaling Yu, Shaomin Lin, Xianxue Li, Chenyang Zhang and Ji Luo
Inorganics 2026, 14(1), 30; https://doi.org/10.3390/inorganics14010030 - 18 Jan 2026
Viewed by 473
Abstract
Aluminum nitride (AlN) possesses an exceptional combination of high thermal conductivity and an ultra-wide band gap, rendering it highly attractive for electronic packaging and semiconductor substrate applications. In this study, surface chemical modification of AlN powders was performed employing low-molecular-weight organic acids, successfully [...] Read more.
Aluminum nitride (AlN) possesses an exceptional combination of high thermal conductivity and an ultra-wide band gap, rendering it highly attractive for electronic packaging and semiconductor substrate applications. In this study, surface chemical modification of AlN powders was performed employing low-molecular-weight organic acids, successfully yielding hydrolysis-resistant AlN powders. The underlying mechanisms responsible for the improved anti-hydrolysis performance imparted by both single organic acids and the composite acid were systematically investigated using X-ray diffraction (XRD), scanning electron microscope (SEM), and transmission electron microscope (TEM), characterization techniques. The results reveal that Oxalic acid within the concentration range of 0.25 M to 1.50 M partially inhibits the hydrolysis of aluminum nitride (AlN); however, hydrolysis products such as aluminum hydroxide are still formed. In the case of citric acid, a higher concentration leads to a stronger anti-hydrolysis effect on the modified AlN. No significant hydrolysis products were detected when the AlN sample was treated in a 1 M aqueous citric acid solution at 80 °C. The effectiveness of the organic acids in enhancing the hydrolysis resistance of AlN follows the order: composite acid (citric acid + oxalic acid) > citric acid > oxalic acid. Under the action of the composite acid, the AlN diffraction peaks exhibit the highest intensity. Furthermore, TEM observations reveal the formation of an amorphous protective layer on the surface, which contributes to the improved hydrolysis resistance. Analytical results confirmed that the surface modification process, mediated by citric acid, oxalic acid, or the composite acid, involved an esterification-like reaction between the surface hydroxyl groups on AlN and the chemical modifiers. This reaction led to the formation of a continuous protective coordination layer encapsulating the AlN particles, which serves as an effective diffusion barrier against water molecules, thereby significantly inhibiting the hydrolysis reaction. Full article
(This article belongs to the Section Inorganic Materials)
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11 pages, 1586 KB  
Article
Toward Detection of Inert PFAS: Single/Few-CNT Devices for Sensing PFOA
by Collins Dormena, Obed Appiah and Taher Ghomian
Sensors 2025, 25(24), 7653; https://doi.org/10.3390/s25247653 - 17 Dec 2025
Viewed by 691
Abstract
Electron transport in carbon nanotubes (CNTs) is highly sensitive to interactions with their local environment, making them promising candidates for sensing applications. Specifically, this could allow detection of electrochemically and optically inert compounds that typically require complex and expensive analytical techniques. In this [...] Read more.
Electron transport in carbon nanotubes (CNTs) is highly sensitive to interactions with their local environment, making them promising candidates for sensing applications. Specifically, this could allow detection of electrochemically and optically inert compounds that typically require complex and expensive analytical techniques. In this study, we examine how single-walled carbon nanotubes (SWCNTs) respond to perfluorooctanoic acid (PFOA), a common per- and polyfluoroalkyl substance (PFAS). To improve sensitivity, we employ a single/few-CNT device setup where a small number of SWCNTs were aligned across nanogaps between gold electrodes with the dielectrophoresis method. This structure addresses the challenges of large CNT networks, such as inter-CNT interactions, drift, and degradation, resulting in improved stability for practical applications. Results showed that device resistance drops as a function of PFOA concentrations. Additionally, positive gate voltage enhances sensitivity by attracting negatively charged PFOA molecules to the SWCNT surface. Specifically, we report that the sensitivity increases by nearly an order of magnitude under a 0.3 V gate bias. Impedance spectroscopy reveals distinct amplitude and phase signatures, enabling selective detection of PFOA among different analytes. Applying gate voltage further enhances sensor selectivity, highlighting the potential of gated SWCNT devices for accurate and selective environmental monitoring. The device demonstrates promising performance as a robust platform for creating single/few-CNT nanosensors for detecting electrochemically and optically inert substances like PFAS molecules. Full article
(This article belongs to the Special Issue Bio & Chem Sensors: Young Scientists in the Americas)
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14 pages, 4136 KB  
Article
Tuning Surface-Enhanced Raman Scattering (SERS) via Filling Fraction and Period in Gold-Coated Bullseye Gratings
by Ziqi Li, Yaming Cheng, Carlos Fernandes, Xiaolu Wang and Harry E. Ruda
Nanomaterials 2025, 15(24), 1863; https://doi.org/10.3390/nano15241863 - 11 Dec 2025
Cited by 1 | Viewed by 900
Abstract
Surface-enhanced Raman scattering (SERS) is a highly sensitive analytical technique capable of single-molecule detection, yet its performance strongly depends on the underlying plasmonic architecture. In this study, we developed a robust SERS platform based on long-range–ordered bullseye plasmonic nano-gratings with tunable period and [...] Read more.
Surface-enhanced Raman scattering (SERS) is a highly sensitive analytical technique capable of single-molecule detection, yet its performance strongly depends on the underlying plasmonic architecture. In this study, we developed a robust SERS platform based on long-range–ordered bullseye plasmonic nano-gratings with tunable period and filling fraction, fabricated via electron beam lithography and reactive ion etching and uniformly coated with a thin gold film. These concentric nanostructures support efficient surface plasmon resonance and radial SPP focusing, enabling intense electromagnetic field enhancement across the substrate. Using this platform, we achieved quantitative detection of Rhodamine 6G with enhancement factors of 105. Notably, our results reveal a previously unrecognized mechanistic insight: the geometric configuration producing the strongest local electric fields does not yield the highest SERS enhancement, due to misalignment between the dominant field orientation and the molecular polarizability tensor. This finding explains the non-monotonic dependence of SERS performance on grating geometry and introduces a new design principle in which both field strength and field–molecule alignment must be co-optimized. Overall, this work provides a mechanistic framework for rationally engineering plasmonic substrates for sensitive and quantitative molecular detection. Full article
(This article belongs to the Section Nanophotonics Materials and Devices)
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33 pages, 7384 KB  
Review
Nanoscale Imaging of Biological Tissues: Techniques, Challenges and Emerging Frontiers
by Rohit Kajla, Rebecca Leija-Cardenas, Meghraj Magadi Shivalingaiah, Muhammad Waqas Shabbir and Zihao Ou
Nanomaterials 2025, 15(23), 1752; https://doi.org/10.3390/nano15231752 - 22 Nov 2025
Cited by 2 | Viewed by 1778
Abstract
Nanoscale characterization of biological tissues bridges molecular identity with structural, mechanical, and chemical organization, enabling high-resolution insights into intact specimens. This review provides a comprehensive overview of the principal imaging modalities that resolve cellular and subcellular features in biological tissues. Electron microscopy techniques [...] Read more.
Nanoscale characterization of biological tissues bridges molecular identity with structural, mechanical, and chemical organization, enabling high-resolution insights into intact specimens. This review provides a comprehensive overview of the principal imaging modalities that resolve cellular and subcellular features in biological tissues. Electron microscopy techniques offer ultrastructural details and volumetric reconstructions with sectioning and tomography techniques. Optical nanoscopy approaches such as single-molecule localization microscopy, stimulated emission depletion microscopy, structural illumination microscopy, and expansion microscopy achieve fluorescence-based mapping with tens-of-nanometer precision. Complementary platforms like atomic force microscopy and nanoscale secondary ion mass spectrometry extend nanoscale characterization into mechanical and chemical domains. Artificial intelligence has emerged as a transformative tool for segmentation, image restoration, and volumetric reconstruction, addressing bottlenecks in throughput and interpretability. From practical applications on biological tissues, we evaluate each technique’s strengths, limitations, and potential for clinical applications. The review concludes with a discussion on emerging directions, including live-tissue nanoscopy, correlative light and electron microscopy, and machine-driven high-throughput imaging for further investigation of nanoscale biological structures and functions. Full article
(This article belongs to the Special Issue Nanomaterials for Biomedical and Environmental Applications)
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18 pages, 4422 KB  
Article
Tuning the Activity of 1,5-Diamino-naphthalene Through an Asymmetric Mono-Amidation with Pyroglutamic Acid
by Davide Carboni, Marta Cadeddu, Federico Olia, Federico Fiori, Roberto Anedda, Massimo Carraro, Luca Malfatti and Plinio Innocenzi
Molecules 2025, 30(8), 1802; https://doi.org/10.3390/molecules30081802 - 17 Apr 2025
Cited by 2 | Viewed by 1313
Abstract
The class of diamino-naphthalene exhibits antioxidant properties, which are partly related to the relative positions of the two amino groups. This study demonstrates how the reactivity of one of these compounds, 1,5-diamino-naphthalene (DAN), can be adjusted by introducing a single amide bond through [...] Read more.
The class of diamino-naphthalene exhibits antioxidant properties, which are partly related to the relative positions of the two amino groups. This study demonstrates how the reactivity of one of these compounds, 1,5-diamino-naphthalene (DAN), can be adjusted by introducing a single amide bond through a simple thermal coupling with l-pyroglutamic acid (PyroGlu). The solventless thermal reaction between PyroGlu and DAN at 160 °C yielded a new mono-pyroglutanilide compound (PyroDAN) that was characterized using various analytical techniques, including a thermal and infrared analysis, HRMS (ESI), and one- (1D) and two-dimensional (2D) NMR. The optical properties were investigated using UV-Vis and fluorescence spectroscopy. Additionally, two chemical standard assays were used to measure both the antioxidant and pro-oxidant properties of PyroDAN. The molecule has shown nearly negligible pro-oxidant activity, while a mild antioxidant activity is still retained. These findings indicate that the transformation of DAN into a mono-pyroglutanilide derivative breaks the original molecular symmetry and effectively modifies the electronic distribution of the aromatic system, suppressing the oxidant properties while keeping a mild antioxidant activity. Furthermore, the tuneable fluorescent properties of PyroDAN—the mild antioxidant activity and the inhibition of the cytologically harmful pro-oxidant properties—suggest promising applications in bioimaging and other biological fields. Full article
(This article belongs to the Section Organic Chemistry)
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15 pages, 3479 KB  
Article
Synthesis, Crystal Structures, Hirshfeld Surface Analysis, Computational Investigations, Thermal Properties, and Electrochemical Analysis of Two New Cu(II) and Co(II) Coordination Polymers with the Ligand 5-Methyl-1-(pyridine-4-yl-methyl)-1H-1,2,3-triazole-4-carboxylate
by Markus Bergedahl, Pilar Narea, Jaime Llanos, Ruth Pulido, Nelson Naveas, Pilar Amo-Ochoa, Félix Zamora, Gerzón E. Delgado, Felipe M. Galleguillos Madrid, Yasna León and Iván Brito
Int. J. Mol. Sci. 2025, 26(4), 1671; https://doi.org/10.3390/ijms26041671 - 15 Feb 2025
Cited by 5 | Viewed by 3116
Abstract
Two new Cu(II) (CP1) and Co(II) (CP2) coordination polymers (CPs) with the triazole ligand 5-methyl-1-(pyridin-4-yl-methyl)-1H-1,2,3-triazole-4-carboxylate (L1) have been synthesized and structurally characterized by SCXRD (Single Crystal X-Ray Difraccion), PXRD (Power X-Ray Difracction), FT-IR (Fourier Transform Infrared), TG (Theermo Gravimetric), and electrochemical techniques. Both [...] Read more.
Two new Cu(II) (CP1) and Co(II) (CP2) coordination polymers (CPs) with the triazole ligand 5-methyl-1-(pyridin-4-yl-methyl)-1H-1,2,3-triazole-4-carboxylate (L1) have been synthesized and structurally characterized by SCXRD (Single Crystal X-Ray Difraccion), PXRD (Power X-Ray Difracction), FT-IR (Fourier Transform Infrared), TG (Theermo Gravimetric), and electrochemical techniques. Both CPs were obtained at the water/n-butanol interface by reacting nitrate salts of each metal with the NaL1 ligand. SCXRD analysis revealed that CP1 (Coordination Polymer 1) and CP2 (Coordination Polymer 2) crystallize in the monoclinic space groups C2/c (No. 15) and P21/n (No. 14), respectively, forming 1D zigzag chain structures, which further lead to a 2D supramolecular network through O-H⋯O and C-H⋯O hydrogen bond interactions, respectively. In CP1, the supramolecular structure is assembled by hydrogen bonds involving water molecules. In contrast, CP2 forms its supramolecular network mainly through hydrogen bonds between adjacent triazole ligand molecules. Hirshfeld surface analysis revealed that the most significant contributions to the crystal packing come from H⋯O/O⋯H, H⋯H, H⋯N/N⋯H, and H⋯C/C⋯H interactions. In addition, FT-IR provided information on the functional groups involved in the coordination, while the decomposition patterns of both CPs were evaluated by TGA. Electrochemical studies conducted in a saline environment showed that CP1 exhibits superior hydrogen evolution reaction (HER) kinetics compared to CP2, as evidenced by a higher exchange current density and a lower Tafel slope. Density functional theory calculations and experimental bandgap measurements provided a deeper understanding of the electronic properties influencing the electrochemical behavior. The results highlight the potential of CP1 as an efficient catalyst for HER under saline conditions. Full article
(This article belongs to the Section Physical Chemistry and Chemical Physics)
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39 pages, 2817 KB  
Review
Advances in Biosensor Applications of Metal/Metal-Oxide Nanoscale Materials
by Md Abdus Subhan, Newton Neogi, Kristi Priya Choudhury and Mohammed M. Rahman
Chemosensors 2025, 13(2), 49; https://doi.org/10.3390/chemosensors13020049 - 3 Feb 2025
Cited by 21 | Viewed by 6665
Abstract
Biosensing shows promise in detecting cancer, renal disease, and other illnesses. Depending on their transducing processes, varieties of biosensors can be divided into electrochemical, optical, piezoelectric, and thermal biosensors. Advancements in material production techniques, enzyme/protein designing, and immobilization/conjugation approaches can yield novel nanoparticles [...] Read more.
Biosensing shows promise in detecting cancer, renal disease, and other illnesses. Depending on their transducing processes, varieties of biosensors can be divided into electrochemical, optical, piezoelectric, and thermal biosensors. Advancements in material production techniques, enzyme/protein designing, and immobilization/conjugation approaches can yield novel nanoparticles with further developed functionality. Research in cutting-edge biosensing with multifunctional nanomaterials, and the advancement of practical biochip plans utilizing nano-based sensing material, are of current interest. The miniaturization of electronic devices has enabled the growth of ultracompact, compassionate, rapid, and low-cost sensing technologies. Some sensors can recognize analytes at the molecule, particle, and single biological cell levels. Nanomaterial-based sensors, which can be used for biosensing quickly and precisely, can replace toxic materials in real-time diagnostics. Many metal-based NPs and nanocomposites are favorable for biosensing. Through direct and indirect labeling, metal-oxide NPs are extensively employed in detecting metabolic disorders, such as cancer, diabetes, and kidney-disease biomarkers based on electrochemical, optical, and magnetic readouts. The present review focused on recent developments across multiple biosensing modalities using metal/metal-oxide-based NPs; in particular, we highlighted the specific advancements of biosensing of key nanomaterials like ZnO, CeO2, and TiO2 and their applications in disease diagnostics and environmental monitoring. For example, ZnO-based biosensors recognize uric acid, glucose, cholesterol, dopamine, and DNA; TiO2 is utilized for SARS-CoV-19; and CeO2 for glucose detection. Full article
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29 pages, 4274 KB  
Review
Role of Ionizing Radiation Techniques in Polymeric Hydrogel Synthesis for Tissue Engineering Applications
by Ion Călina, Maria Demeter, Anca Scărișoreanu, Awn Abbas and Muhammad Asim Raza
Gels 2025, 11(1), 47; https://doi.org/10.3390/gels11010047 - 8 Jan 2025
Cited by 17 | Viewed by 4010
Abstract
Hydrogels are widely utilized in industrial and scientific applications owing to their ability to immobilize active molecules, cells, and nanoparticles. This capability has led to their growing use in various biomedical fields, including cell culture and transplantation, drug delivery, and tissue engineering. Among [...] Read more.
Hydrogels are widely utilized in industrial and scientific applications owing to their ability to immobilize active molecules, cells, and nanoparticles. This capability has led to their growing use in various biomedical fields, including cell culture and transplantation, drug delivery, and tissue engineering. Among the available synthesis techniques, ionizing-radiation-induced fabrication stands out as an environmentally friendly method for hydrogel preparation. In alignment with the current requirements for cleaner technologies, developing hydrogels using gamma and electron beam irradiation technologies represents a promising and innovative approach for their biomedical applications. A key advantage of these methods is their ability to synthesize homogeneous three-dimensional networks in a single step, without the need for chemical initiators or catalysts. Additionally, the fabrication process is controllable by adjusting the radiation dose and dose rate. Full article
(This article belongs to the Special Issue Novel Gels for Topical Applications)
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24 pages, 6781 KB  
Article
A Structure and Magnetism Study of {MnII3MnIVLnIII3} Coordination Complexes with Ln = Dy, Yb
by Victoria Mazalova, Tatiana Asanova, Igor Asanov and Petra Fromme
Inorganics 2024, 12(11), 286; https://doi.org/10.3390/inorganics12110286 - 31 Oct 2024
Viewed by 2125
Abstract
We report the research results of polynuclear complexes consisting of 3d-4f mixed-metal cores that are maintained by acetate ligands and multidentate Schiff base ligands with structurally exposed thioether groups. The presence of the latter at the periphery of these neutral compounds enables their [...] Read more.
We report the research results of polynuclear complexes consisting of 3d-4f mixed-metal cores that are maintained by acetate ligands and multidentate Schiff base ligands with structurally exposed thioether groups. The presence of the latter at the periphery of these neutral compounds enables their anchoring onto substrate surfaces. Specifically, we investigated the electronic and magnetic properties as well as the structural arrangement in {MnII3MnIVLnIII3} with Ln = Dy, Yb coordination complexes using various complementary methods. We studied the electronic and atomic structure of the target compounds using the XAS and XES techniques. The molecular structures of the compounds were determined using density functional theory, and the magnetic data were obtained as a function of the magnetic field. Using the XMCD method, we followed the changes in the electronic and magnetic properties of adsorbed magnetic compounds induced by the reaction of ligands through interaction with the substrate. The complexes show antiferromagnetic exchange interactions between Mn and Ln ions. The spectroscopic analyses confirmed the structural and electronic integrity of complexes in organic solution. This study provides important input for a full understanding of the dependence of the magnetic properties and the molecule–substrate interaction of single adsorbed molecules on the type of ligands. It highlights the importance of chemical synthesis for controlling and tailoring the magnetic properties of metalorganic molecules for their use as optimized building blocks of future molecular spin electronics. Full article
(This article belongs to the Section Coordination Chemistry)
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29 pages, 3830 KB  
Review
Utilizing Molecular Dynamics Simulations, Machine Learning, Cryo-EM, and NMR Spectroscopy to Predict and Validate Protein Dynamics
by Ahrum Son, Woojin Kim, Jongham Park, Wonseok Lee, Yerim Lee, Seongyun Choi and Hyunsoo Kim
Int. J. Mol. Sci. 2024, 25(17), 9725; https://doi.org/10.3390/ijms25179725 - 8 Sep 2024
Cited by 18 | Viewed by 8027
Abstract
Protein dynamics play a crucial role in biological function, encompassing motions ranging from atomic vibrations to large-scale conformational changes. Recent advancements in experimental techniques, computational methods, and artificial intelligence have revolutionized our understanding of protein dynamics. Nuclear magnetic resonance spectroscopy provides atomic-resolution insights, [...] Read more.
Protein dynamics play a crucial role in biological function, encompassing motions ranging from atomic vibrations to large-scale conformational changes. Recent advancements in experimental techniques, computational methods, and artificial intelligence have revolutionized our understanding of protein dynamics. Nuclear magnetic resonance spectroscopy provides atomic-resolution insights, while molecular dynamics simulations offer detailed trajectories of protein motions. Computational methods applied to X-ray crystallography and cryo-electron microscopy (cryo-EM) have enabled the exploration of protein dynamics, capturing conformational ensembles that were previously unattainable. The integration of machine learning, exemplified by AlphaFold2, has accelerated structure prediction and dynamics analysis. These approaches have revealed the importance of protein dynamics in allosteric regulation, enzyme catalysis, and intrinsically disordered proteins. The shift towards ensemble representations of protein structures and the application of single-molecule techniques have further enhanced our ability to capture the dynamic nature of proteins. Understanding protein dynamics is essential for elucidating biological mechanisms, designing drugs, and developing novel biocatalysts, marking a significant paradigm shift in structural biology and drug discovery. Full article
(This article belongs to the Special Issue Advanced Research on Protein Structure and Protein Dynamics)
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11 pages, 2922 KB  
Article
Producing Freestanding Single-Crystal BaTiO3 Films through Full-Solution Deposition
by Guoqiang Xi, Hangren Li, Dongfei Lu, Xudong Liu, Xiuqiao Liu, Jie Tu, Qianqian Yang, Jianjun Tian and Linxing Zhang
Nanomaterials 2024, 14(17), 1456; https://doi.org/10.3390/nano14171456 - 7 Sep 2024
Cited by 2 | Viewed by 2893
Abstract
Strontium aluminate, with suitable lattice parameters and environmentally friendly water solubility, has been strongly sought for use as a sacrificial layer in the preparation of freestanding perovskite oxide thin films in recent years. However, due to this material’s inherent water solubility, the methods [...] Read more.
Strontium aluminate, with suitable lattice parameters and environmentally friendly water solubility, has been strongly sought for use as a sacrificial layer in the preparation of freestanding perovskite oxide thin films in recent years. However, due to this material’s inherent water solubility, the methods used for the preparation of epitaxial films have mainly been limited to high-vacuum techniques, which greatly limits these films’ development. In this study, we prepared freestanding single-crystal perovskite oxide thin films on strontium aluminate using a simple, easy-to-develop, and low-cost chemical full-solution deposition technique. We demonstrate that a reasonable choice of solvent molecules can effectively reduce the damage to the strontium aluminate layer, allowing successful epitaxy of perovskite oxide thin films, such as 2-methoxyethanol and acetic acid. Molecular dynamics simulations further demonstrated that this is because of their stronger adsorption capacity on the strontium aluminate surface, which enables them to form an effective protective layer to inhibit the hydration reaction of strontium aluminate. Moreover, the freestanding film can still maintain stable ferroelectricity after release from the substrate, which provides an idea for the development of single-crystal perovskite oxide films and creates an opportunity for their development in the field of flexible electronic devices. Full article
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19 pages, 6540 KB  
Article
Supramolecular Assemblies in Mn(II) and Zn(II) Metal–Organic Compounds Involving Phenanthroline and Benzoate: Experimental and Theoretical Studies
by Mridul Boro, Subham Banik, Rosa M. Gomila, Antonio Frontera, Miquel Barcelo-Oliver and Manjit K. Bhattacharyya
Inorganics 2024, 12(5), 139; https://doi.org/10.3390/inorganics12050139 - 13 May 2024
Cited by 10 | Viewed by 3076
Abstract
Two new Mn(II) and Zn(II) metal–organic compounds of 1,10-phenanthroline and methyl benzoates viz. [Mn(phen)2Cl2]2-ClBzH (1) and [Zn(4-MeBz)2(2-AmPy)2] (2) (where 4-MeBz = 4-methylbenzoate, 2-AmPy = 2-aminopyridine, phen = 1,10-phenanthroline, 2-ClBzH = [...] Read more.
Two new Mn(II) and Zn(II) metal–organic compounds of 1,10-phenanthroline and methyl benzoates viz. [Mn(phen)2Cl2]2-ClBzH (1) and [Zn(4-MeBz)2(2-AmPy)2] (2) (where 4-MeBz = 4-methylbenzoate, 2-AmPy = 2-aminopyridine, phen = 1,10-phenanthroline, 2-ClBzH = 2-chlorobenzoic acid) were synthesized and characterized using elemental analysis, TGA, spectroscopic (FTIR, electronic) and single crystal X-ray diffraction techniques. The crystal structure analysis of the compounds revealed the presence of various non-covalent interactions, which provides stability to the crystal structures. The crystal structure analysis of compound 1 revealed the formation of a supramolecular dimer of 2-ClBzH enclathrate within the hexameric host cavity formed by the neighboring monomeric units. Compound 2 is a mononuclear compound of Zn(II) where flexible binding topologies of 4-CH3Bz are observed with the metal center. Moreover, various non-covalent interactions, such as lp(O)-π, lp(Cl)-π, C–H∙∙∙Cl, π-stacking interactions as well as N–H∙∙∙O, C–H∙∙∙O and C–H∙∙∙π hydrogen bonding interactions, are found to be involved in plateauing the molecular self-association of the compounds. The remarkable enclathration of the H-bonded 2-ClBzH dimer into a supramolecular cavity formed by two [Mn(phen)2Cl2] complexes were further studied theoretically using density functional theory (DFT) calculations, the non-covalent interaction (NCI) plot index and quantum theory of atoms in molecules (QTAIM) computational tools. Synergistic effects were also analyzed using molecular electrostatic potential (MEP) surface analysis. Full article
(This article belongs to the Special Issue Feature Papers in Organometallic Chemistry 2024)
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10 pages, 2525 KB  
Communication
Comparative Characterisation of Proliferation and Apoptosis of Colonic Epithelium after Electron Irradiation with 2 GY and 25 GY
by Grigory Demyashkin, Elza Karakaeva, Susanna Saakian, Natalia Tarusova, Amina Guseinova, Anita Vays, Konstantin Gotovtsev, Dmitrii Atiakshin, Petr Shegai and Andrey Kaprin
Int. J. Mol. Sci. 2024, 25(2), 1196; https://doi.org/10.3390/ijms25021196 - 18 Jan 2024
Viewed by 1819
Abstract
Development of new techniques for multimodal treatment and diagnostics of various neoplasms and the improvement of current techniques can significantly increase the life expectancy of patients with carcinomas of the colon and abdominal-cavity organs, since prevention of various side effects of radiation therapy [...] Read more.
Development of new techniques for multimodal treatment and diagnostics of various neoplasms and the improvement of current techniques can significantly increase the life expectancy of patients with carcinomas of the colon and abdominal-cavity organs, since prevention of various side effects of radiation therapy is one of the main problems of oncological care. Electron irradiation is one of the most promising types of radiation therapy. There are no data on proliferation and apoptosis of the colon epithelium after irradiation with electrons, especially in different modes (single and summary). Morphological evaluation of apoptosis and proliferation of colonic epithelium after local irradiation with electrons were conducted at doses of 2 Gy (Gray) and 25 Gy. Colon fragments from sexually mature Wistar rats (n = 50, body weight 200 ± 10 g) were divided into three groups: I—control (n = 10); II—experimental group (n = 20; local single electron irradiation at a dose of 2 Gy); III—experimental group (n = 30) with local fractional irradiation with electrons at a total dose of 25 Gy. They were studied using light microscopy using hematoxylin and eosin staining and immunohistochemical reactions with antibodies to Ki-67 and caspase-3 (Cas3). Morphological disorders were accompanied by increased expression of pro-apoptotic molecules (caspase-3), and the period of regeneration by proliferative marker (Ki-67). Colon electron irradiation led to disturbances in the histoarchitecture of varying severity, and an increase in cell apoptosis was observed (increased expression of caspase-3 and decrease in Ki-67). In addition, modulation of the PI3K/AKT and MAPK/ERK signalling pathways was detected. The most pronounced destructive changes were observed in the group of 25 Gy fractionated electron irradiation. Full article
(This article belongs to the Section Biochemistry)
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16 pages, 5808 KB  
Article
Na2Ti3O7@RF@Ag Heterostructures as Efficient Substrates for SERS and Photocatalytic Applications
by Yu-Cheng Chang, I-Chun Lin, Ning-Chien Chin, Sin-Ei Juang and Chia-Man Chou
Molecules 2024, 29(1), 218; https://doi.org/10.3390/molecules29010218 - 30 Dec 2023
Cited by 3 | Viewed by 2380
Abstract
A multi-step procedure was effectively employed to synthesize innovative three-dimensional (3D) heterostructures encompassing sodium titanate (Na2Ti3O7) nanowire cores, an intermediate resorcinol–formaldehyde (RF) layer, and outer silver (Ag) nanoparticle sheaths, referred to as Na2Ti3O [...] Read more.
A multi-step procedure was effectively employed to synthesize innovative three-dimensional (3D) heterostructures encompassing sodium titanate (Na2Ti3O7) nanowire cores, an intermediate resorcinol–formaldehyde (RF) layer, and outer silver (Ag) nanoparticle sheaths, referred to as Na2Ti3O7@RF@Ag heterostructures. Initially, a one-step hydrothermal technique facilitated the direct growth of single-crystal Na2Ti3O7 nanowires onto a flexible Ti foil. Subsequently, a two-step wet chemical process facilitated the sequential deposition of an RF layer and Ag nanoparticles onto the Na2Ti3O7 nanowires at a low reaction temperature. Optimal concentrations of silver nitrate and L-ascorbic acid can lead to the cultivation of Na2Ti3O7@RF@Ag heterostructures exhibiting heightened surface-enhanced Raman scattering (SERS), which is particularly beneficial for the detection of rhodamine B (RhB) molecules. This phenomenon can be ascribed to the distinctive geometry of the Na2Ti3O7@RF@Ag heterostructures, which offer an increased number of hot spots and surface-active sites, thereby showcasing notable SERS enhancement, commendable reproducibility, and enduring stability over the long term. Furthermore, the Na2Ti3O7@RF@Ag heterostructures demonstrate remarkable follow-up as first-order chemical kinetic and recyclable photocatalysts for the photodecomposition of an RhB solution under UV light irradiation. This result can be attributed to the enhanced inhibition of electron–hole pair recombination and increased surface-active sites. Full article
(This article belongs to the Special Issue Applications of Nanoparticles in Catalysis, Sensing, and Biomedicine)
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