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The self-assembling morphologies of proteins, nucleic acids, and peptides are well correlated with their functioning in biological systems. In spite of extensive studies for the morphologies regulating, the directional control of the assembly morphology structure for the peptides still remains challenging. Here, the directional structure control of a bola-like peptide Ac-KIIF-CONH2 (KIIF) was realized by introducing different amount of acetonitrile to the system. The morphologies were characterized by transmission electron microscopy (TEM) and atomic force microscopy (AFM), and the secondary structure was evaluated by circular dichroism (CD) and Fourier transform infrared spectroscopy (FTIR). The results demonstrated that the introducing of different amount of acetonitrile has significantly tuned the hydrophobic interactions amongst the side chains, thus affecting the self-assembling morphologies. As acetonitrile content increased, the assemblies changed from nanotubes to helical/twisted ribbons and then to thin fibrils, with a steady decrease in the width. In contrast, the assemblies changed from thin fibrils to helical/twisted ribbons, and then to matured nanotubes, exhibiting a steady increase in the width with peptide concentration increasing. Complementary molecular dynamics (MD) simulations demonstrated the important role of acetonitrile in controlling the hydrophobic interactions, providing microscopic evidence for the structure transition process. We believe such observations provide important insights into the design and fabrication of functional materials with controlled shape and size.
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Interacciones Hidrofóbicas e Hidrofílicas , Simulación de Dinámica Molecular , Péptidos/química , Conformación Proteica en Lámina beta , Acetonitrilos/química , Tamaño de la Partícula , Propiedades de SuperficieRESUMEN
The interfacial interaction of carbon nanotubes (CNTs) significantly enhances the output capability of piezoelectric nanogenerators (PENGs). However, overcoming the limitation of low specific surface area in one-dimensional materials remains a significant challenge. This paper introduces a hydrothermal method for composite MOF (C-M) using CNTs and MOF-5, demonstrating localized co-doping between them. Coaxial electrospun piezoelectric fiber membranes (C-MNF) were then prepared using PVDF/PAN as the matrix. Benefiting from C-M's excellent crystallinity and its synergistic interaction with the polymer matrix, the C-MNF-based PENG showed a 125 % increase in output voltage, reaching â¼25 V, compared to coaxial membranes simply mixing MOF-5 and CNTs. As a result, its short-circuit current was â¼1.8 µA, with a piezoelectric coefficient d33 of â¼400 pC N-1. Consequently, this material exhibits superior piezoelectric output capabilities, paving the way for future functional material fabrication.
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Innovative technology and methods are crucial for making pure and refreshing water. Two main methods are present to delete soluble salts from water: membrane processes and thermal processes. A beneficial membrane technique is reverse electrodialysis. This research used molecular dynamics (MD) simulation to investigate how channel roughness affected particle diffusion and permeability in carbon nanotubes (CNTs) via the reverse electrodialysis process. The results indicate that adding roughness in the CNT duct increased the force between the primary fluid and the duct. Using an armchair-edged CNT structure maximized the electric current in the sample. Furthermore, the roughness increased the intensity of force in the channel, which was due to gravity, leading to a decrease in the mobility of fluid particles. Additionally, several broken hydrogen bonds inside the simulation box increased from 116 to 128 in the duct sample with roughness.
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Dielectric Modulated Field-Effect Transistors (DMFETs) have emerged as promising candidates for label-free bioanalyte detection. However, the inherent short-channel effects in conventional DMFETs increase their static power dissipation significantly and limit their scalability and sensitivity. Therefore, FETs based on alternate conduction mechanism such as tunneling (TFETs), which are immune to the short-channel effects, appear to be a lucrative alternative to the MOSFETs for biosensing application. In this work, we propose a novel Dual Cavity Dielectric Modulated Nanotube Tunnel FET (DCDM NTTFET)-based label-free biosensor consisting of a Ge source and nanocavities within the core as well as a shell gate stack, which not only outperforms the conventional MOSFET and advanced nanowire (NW) TFET-based biosensors in terms of energy-efficiency and scalability but also exhibits a significantly high drain current sensitivity (SION = 2.9 × 108) and a threshold voltage sensitivity (SVth = 0.85), and a considerably high selectivity of more than 6 orders of magnitude. We also perform a comprehensive design space exploration for the proposed DCDM NTTFET and provide necessary design guidelines to further improve its performance considering the practical artifacts such as steric hindrance.
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Herein, we report the synthesis of double-walled noncovalent carbon nanotubes (CNTs) through host-guest complexation of nanotube fragments and tube-forming crystal engineering. As the smallest fragment of double-walled CNTs, a host-guest complex of perfluorocycloparaphenylene (PFCPP) and carbon nanobelt (CNB) was synthesized by mixing them in solvents. The immediate complexation of the PF[12]CPPâ(6,6)CNB complex with a remarkably high association constant (Ka) of 2×105 L/mol was observed. Time-dependent 1H NMR and thermogravimetry measurements revealed that the stability of (6,6)CNB was significantly improved by encapsulation. X-ray crystallography confirmed the robust belt-in-ring structure of this complex. As indicated by the short distance between PF[12]CPP and (6,6)CNB (2.8 Å), intermolecular orbital interactions exist between the belt and the ring, which were further supported by theoretical calculation and phosphorescence quenching experiments. While the PF[12]CPPâ(6,6)CNB complex adopts various crystal packing structures, chloroform was discovered to be a magic "glue" solvent inducing one-dimensional alignment of the PF[12]CPPâ(6,6)CNB complex to build an unprecedented double-walled noncovalent CNT structure.
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Developing hydrogen sensors with parts per billion-level detection limits, high response, and high stability is crucial for ensuring safety across various industries (e.g., hydrogen fuel cells, chemical manufacturing, and aerospace). Despite extensive research on parts per billion-level detection, it still struggles to meet stringent requirements. Here, high performance and ppb-level H2 sensing have been developed with palladium-doped iron oxide nanotubes (Pd@Fe2O3 NTs), which have been prepared by FeCl3·6H2O, PdCl2, and PVP electrospinning and air calcination techniques. Various characterization techniques (FESEM, TEM, XRD, and so forth) were used to prove that the nanotube structure was successfully prepared, and the doping of Pd nanoparticles was realized. The experiments show that palladium doping can significantly improve the gas response of iron oxide nanotubes. Specifically, 0.59 wt % Pd@Fe2O3 NTs have high response (Ra/Rg = 41,000), high selectivity, and excellent repeatability for 200 ppm hydrogen at 300 °C. Notably, there was still a significant response at a low detection limit (LOD) of 50 ppb (Ra/Rg = 16.8). This excellent hydrogen sensing performance may be attributed to the high surface area of the nanotubes, the p-n heterojunction of PdO/Fe2O3, which allows more oxygen to be adsorbed on the surface, and the catalytic action of Pd nanoparticles, which promotes the reaction of hydrogen with surface-adsorbed oxygen.
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A combination of analytical ultracentrifugation (AUC) and fluorescence spectroscopy are utilized to orthogonally probe compositions of adsorbed surfactant layers on the surface of (7,5) species single-wall carbon nanotubes (SWCNTs) under conditions known to achieve differential partitioning in aqueous two-phase extraction (ATPE) separations. Fluorescence emission intensity and AUC anhydrous particle density measurements independently probe and can discriminate between adsorbed surfactant layers on a (7,5) nanotube comprised of either of two common nanotube dispersants, the anionic surfactants sodium deoxycholate and sodium dodecyl sulfate. Measurements on dispersions containing mixtures of both surfactants indicate near total direct exchange of the dominant surfactant species adsorbed to the carbon nanotube at a critical concentration ratio consistent with the ratio leading to partitioning change in the ATPE separation. By conducting these orthogonal measurements in a complex environment reflective of an ATPE separation, including multiple surfactant and polymer solution components, the results provide direct evidence for the hypothesis that it is the nature of the adsorbed surfactant layer that primarily controls partitioning behavior in selective ATPE separations of SWCNTs.
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BACKGROUND: Digital tomosynthesis has shown potential for increasing specificity and sensitivity compared to radiography for low-dose chest imaging. Prior investigation of the s-DCT system indicated potential, but additional iteration with improved scan speed, power, and angular span was necessary for translation. PURPOSE: The study aims to demonstrate and characterize a second-generation stationary digital chest tomosynthesis (s-DCT) scanner with increased x-ray energy, tube current, and larger angular span. METHODS: The second-generation s-DCT system employed a meter-long linear carbon nanotube (CNT) source array integrated with a digital detector and patient imaging table. Tube output, focal spot size, modulation transfer function (MTF), artifact spread function (ASF), and imaging performance were evaluated. A lung phantom with simulated nodules was imaged for clinical task-based demonstration. RESULTS: The scanner achieved a 6 s scan time, significantly improved from the prior generation's 16 s. The x-ray tube exhibited good current stability, with 20.4 ± 0.6 mA tube current and focal spot size aligned with specifications (IEC 0.8). The MTF confirmed enhanced spatial resolution of 2.4 lp/mm, comparable to commercial chest tomosynthesis systems. The ASF indicated improved depth resolution (5.2 mm, previously 9.5 mm). Phantom imaging showcased visualization of both high and low-attenuation lung nodules. CONCLUSION: The second-generation s-DCT system exhibited improved performance in terms of tube power, scan time, and image quality. Enhanced in-plane and depth resolution, along with faster imaging, suggest potential clinical benefits for improved diagnoses. Further clinical validation is warranted to ascertain the system's clinical utility.
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The demetallation reaction of sulfanyl magnesium(II) porphyrazine with N-ethylphthalimide substituents, followed by remetallation with manganese(II) salts, yields the corresponding manganese(III) derivative (Pz3) with high efficiency. This novel manganese(III) sulfanyl porphyrazine was characterized by HPLC and analyzed using UV-Vis, MS, and FT-IR spectroscopy. Electrochemical experiments of Pz3 conducted in dichloromethane revealed electrochemical activity of the new complex due to both manganese and N-ethylphthalimide substituents redox transitions. Subsequently, Pz3 was deposited on multiwalled carbon nanotubes (MWCNTs), and this hybrid material was then applied to glassy carbon electrodes (GC). The resulting hybrid electroactive electrode material, combining manganese(III) porphyrazine with MWCNTs, showed a significant decrease in overpotential of H2O2 oxidation compared to bare GC or GC electrodes modified with only carbon nanotubes (GC/MWCNTs). This improvement, attributed to the electrocatalytic performance of Mn3+, enabled linear response and sensitive detection of H2O2 at neutral pH. Furthermore, a glucose oxidase (GOx)-containing biosensing platform was developed by modifying the prepared GC/MWCNT/Pz3 electrode for the electrochemical detection of glucose. The bioelectrode incorporating the newly designed Pz3 exhibited good activity in the presence of glucose, confirming effective electronic communication between the Pz3, GOx and MWCNT surface. The linear range for glucose detection was 0.2-3.7 mM.
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Técnicas Biosensibles , Electrodos , Glucosa , Peróxido de Hidrógeno , Manganeso , Nanotubos de Carbono , Nanotubos de Carbono/química , Técnicas Biosensibles/métodos , Técnicas Biosensibles/instrumentación , Peróxido de Hidrógeno/química , Peróxido de Hidrógeno/análisis , Manganeso/química , Glucosa/química , Glucosa/análisis , Catálisis , Técnicas Electroquímicas/métodos , Glucosa Oxidasa/química , Glucosa Oxidasa/metabolismo , Oxidación-ReducciónRESUMEN
The growing importance of electromagnetic interference (EMI) shielding composites in civil engineering has garnered increasing attention. Conductive cement-based composites, incorporating various conductive fillers, such as carbon nanotubes (CNTs), carbon fibers (CFs), and graphene nanoplatelets (GNPs), provide effective solutions due to their high electrical conductivity. While previous studies have primarily focused on improving the overall shielding effectiveness, this research emphasizes balancing the reflection and absorption properties. The experimental results demonstrate an EMI shielding performance exceeding 50 dB, revealing that filler size (nano, micro, or macro) and shape (platelet or fiber) significantly influence both reflection and absorption characteristics. Based on a comprehensive evaluation of the shielding properties, this study highlights the need to consider factors such as reflection versus absorption losses and filler shape or type when optimizing filler content to develop effective cement-based EMI shielding composites.
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A novel label-free electrochemical immunosensor for the ultrasensitive determination of cancer antigen (CA724) was developed using a novel composite of CoAl layered double hydroxides (CoAl-LDH) and carboxyl-functionalized multiwall carbon nanotubes (MWCNTs-COOH) as platform and ferrocenecarboxylic acid (Fc-COOH) as signal label. The MWCNTs-COOH/Fc-COOH@CoAl-LDH composite was prepared by a convenient and simple one-step ultrasonic method, and various characterization techniques consisting of scanning electron microscopy (SEM), transimission electronic microscopy (TEM), TEM-Mapping, fourier transform infrared (FT-IR), X-ray diffraction (XRD) and X-ray photoelectronic energy spectrum (XPS) were applied to study the size and morphological features. Due to its large specific surface area and multilayer structure, the CoAl-LDH can be post-doped to embed a large amount of signal probe to realize the amplification of the internal reference signal Fc. In addition, the higher conductivity of MWCNTs-COOH compensates for the deficiency of CoAl-LDH, which effectively strengthened the electron transfer efficiency of electrochemical signaling substances. The optimal experimental conditions were detected to be 2.5 mmol of Fc-COOH, 4.0 mg/mL of concentration, pH 6.0, incubation time of 40 min, and incubation temperature of 37 â. Under optimal conditions, the fabricated sensor exhibits linearity in a wide dynamic range covering the physiological concentration, from 0.001 to 100 U/mL and the limit of detection (LOD) was 0.03962 mU/mL, the calibration equation is stated as â³I = 7.76363 log10CCA724 + 40.50351 (R2 = 0.99674). The sensor is successfully detects trace levels of CA724 in human serum with excellent recovery rates ranging from 100.52 %-102.30 %, proving the synergy of MWCNTs-COOH/Fc-COOH@CoAl-LDH as a promising platform for electrochemical sensing for clinical detection of other disease markers.
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We conducted atomistic Molecular Dynamics (MD) simulations of DNA-Hairpin molecules encapsulated within Single-Walled Carbon Nanotubes (SWCNTs) at a temperature of 300 K. Our investigation revealed that the structural integrity of the DNA-Hairpin can be maintained within SWCNTs, provided that the diameter of the SWCNT exceeds a critical threshold value. Conversely, when the SWCNT diameter falls below this critical threshold, the DNA-Hairpin undergoes denaturation, even at a temperature of 300 K. The DNA-Hairpin model we employed consisted of a 12-base pair stem and a 3-base loop, and we studied various SWCNTs with different diameters. Our analyses identified a critical SWCNT diameter of 3.39 nm at 300 K. Examination of key structural features, such as hydrogen bonds (H-bonds), van der Waals (vdW) interactions, and other inter-base interactions, demonstrated a significant reduction in the number of H-bonds, vdW energy, and electrostatic energies among the DNA hairpin's constituent bases when confined within narrower SWCNTs (with diameters of 2.84 nm and 3.25 nm). However, it was observed that the increased interaction energy between the DNA-Hairpin and the inner surface of narrower SWCNTs promoted the denaturation of the DNA-Hairpin. In-depth analysis of electrostatic mapping and hydration status further revealed that the DNA-Hairpin experienced inadequate hydration and non-uniform distribution of counter ions within SWCNTs having diameters below the critical value of 3.39 nm. Our inference is that the inappropriate hydration of counter ions, along with their non-uniform spatial distribution around the DNA hairpin, contributes to the denaturation of the molecule within SWCNTs of smaller diameters. For DNA-Hairpin molecules that remained undenatured within SWCNTs, we investigated their mechanical properties, particularly the elastic properties. Our findings demonstrated an increase in the persistence length of the DNA-Hairpin with increasing SWCNT diameter. Additionally, the stretch modulus and torsional stiffness of the DNA-Hairpin were observed to increase as a function of SWCNT diameter, indicating that confinement within SWCNTs enhances the mechanical flexibility of the DNA-Hairpin.
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The success of composite materials is attributed to the nature of bonding at the nanoscale and the resulting structure-related properties. This study reports on the interaction, electronic, and optical properties of diamond nanothread/polymers (cellulose and epoxy) and boron nitride nanotube/calcium silicate hydrate composites using density functional theory modeling. Our findings indicate that the interaction between the nanothread and polymer is due to van der Waals-type bonding. Minor modifications in the electronic structures and absorption spectra are noticed. Conversely, the boron nitride nanotube-calcium silicate hydrate composite displays an electron-shared type of interaction. The electronic structure and optical absorption spectra of the diamond nanothread and boron nitride nanotube in all configurations studied in the aforementioned composite systems are well maintained. Our findings offer an electronic-level perspective into the bonding characteristics and electronic-optical properties of diamond nanothread/polymer and boron nitride nanotube/calcium silicate hydrate composites for developing next-generation materials.
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The processing conditions were varied during the production of polycarbonate-based composites with the multiwalled carbon nanotubes (MWCNTs) Baytubes® C150 P (Bayer MaterialScience AG, Leverkusen, Germany), by melt mixing with an extruder on a laboratory scale. These included the screw design, rotation speed, throughput, feeding position and MWCNT content. Particular attention was paid to the shortening of the MWCNT length as a function of the conditions mentioned. It was found that there is a correlation between the applied specific mechanical energy (SME) during the melt mixing process and MWCNT dispersion, which was quantified by the agglomerate area ratio of the non-dispersed nanotubes based on optical microscopic analysis. The higher the SME value, the lower this ratio, which indicates better dispersion. Above an SME value of about 0.4 kWh/kg, no further improvement in dispersion was achieved. The MWCNT length, as measured by the quantitative analysis of TEM images of the MWCNTs dissolved from the composites, decreased with the SME value down to values of 44% of the original MWCNT length. At a constant loading of 3 wt.%, the tensile strength and tensile modulus were almost independent of the SME, while the elongation at break and notched impact strength showed an increasing trend. The variation in the feeding position showed that feeding the MWCNTs into a side feeder led to slightly better electrical and mechanical properties for both types of MWCNTs studied (Baytubes® C150 P and Nanocyl™ NC7000 (Nanocyl S.A., Sambreville, Belgium)). However, feeding into the hopper led to better CNT dispersion with Baytubes® C150 P, while this was the case with Nanocyl™ NC7000 when feeding into the side feeder. The screw profile had an influence on the dispersion, the MWCNT length and the electrical resistance, but only to a small extent. Distributive screws led to a greater shortening of the MWCNT length than dispersive screws. By varying the MWCNT content, it was shown that a greater MWCNT shortening occurred at higher loadings. Two-stage masterbatch dilution leads to stronger shortening than composite production with direct MWCNT incorporation.
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Carbon nanotubes (CNTs) are extensively utilized in the fabrication of high-performance composites due to their exceptional mechanical, electrical, and thermal characteristics. To investigate the mechanical properties of CNTs filled polymers accurately and effectively, a 3D modeling approach that incorporates the microstructural attributes of CNTs was introduced. Initially, a representative volume element model was constructed utilizing the modified nearest neighbor algorithm. During the modeling phase, a corresponding interference judgment method was suggested, taking into account the potential positional relationships among the CNTs. Subsequently, stress-strain curves of the model under various loading conditions were derived through finite element analysis employing the volume averaging technique. To validate the efficacy of the modeling approach, the stress within a CNT/epoxy resin composite with varying volume fractions under different axial strains was computed. The resulting stress-strain curves were in good agreement with experimental data from the existing literature. Hence, the modeling method proposed in this study provides a more precise representation of the random distribution of CNTs in the matrix. Furthermore, it is applicable to a broader range of aspect ratios, thereby enabling the CNT simulation model to more closely align with real-world models.
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Self-locking structures are often studied in macroscopic energy absorbers, but the concept of self-locking can also be effectively applied at the nanoscale. In particular, we can engineer self-locking mechanisms at the molecular level through careful shape selection or chemical functionalisation. The present work focuses on the use of collapsed carbon nanotubes (CNTs) as self-locking elements. We start by inserting a thin CNT into each of the two lobes of a collapsed larger CNT. We aim to create a system that utilises the unique properties of CNTs to achieve stable configurations and enhanced energy absorption capabilities at the nanoscale. We used molecular dynamics simulations to investigate the mechanical properties of periodic systems realised with such units. This approach extends the application of self-locking mechanisms and opens up new possibilities for the development of advanced materials and devices.
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Simulación de Dinámica Molecular , Nanotubos de Carbono , Nanotubos de Carbono/químicaRESUMEN
Single-walled carbon nanotube (SWNT) films, with exciting electronic properties are increasingly important for next-generation technologies. Here, an Iron-assisted floating solid catalyst chemical vapor deposition (IA-FSCCVD) method is developed for the controlled growth of high-quality and high-purity SWNT films. Titanium carbide nanoparticles with a high melting point are used as the solid catalysts, which provide a stable template for SWNT growth through the perpendicular growth mode. Trace amounts of iron are introduced to increase the efficiency of SWNT growth. Gas chromatography measurements and density functional theory show that the gas-phase iron acts as a pre-cracking assistance for the carbon source, promoting the growth of SWNTs. Carbon nanotube films with a high quality (average IG/ID = 166) are successfully prepared, a small diameter deviation (mean diameter of 1.6 nm), and a high content of SWNTs (97%) using the IA-FSCCVD platform. This work provides a powerful way to prepare the carbon nanotube aggregates with a controlled structure.
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Organic thermoelectrics (TEs) based on carbon nanotubes (CNTs) have attracted much attention with their inherent advantages, such as, earth-abundant elements, broad electronic tunability, and excellent mechanical compliance. However, the inferior TE performance and doping stability of n-type CNTs to those of p-type CNTs have been bottlenecks to establish CNT-based next-generation TEs. Herein, we report a hybrid n-doping method that improves the n-type TE performance and long-term air-stability of water-processable single-walled CNT (SWCNT) and carboxymethyl cellulose (CMC) composite. The hybrid n-doping process with polyethyleneimine (PEI) n-dopant contains primary addition and secondary immersion doping, which causes a simultaneous increase in electrical conductivity and Seebeck coefficient through efficient n-doping and surface energy filtering effect, respectively. Furthermore, the hybrid-doped films exhibit superior long-term stability by inhibiting the oxidation of SWCNT/CMC at nanoscale, which allows to ensure the initial power factor even after storing in ambient for a month. Finally, we successfully demonstrated hybrid-doped SWCNT/CMC-based TEGs with long-term stable output characteristics. This work can offer insights to develop efficient and air-stable n-type organic TE materials and devices.
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Leishmaniasis is a parasitic disease spread by the bite of an infected sandfly and caused by protozoan parasites of the genus Leishmania. Currently, there is no vaccine available for leishmaniasis in humans, and the existing chemotherapy methods face various clinical challenges. The majority of drugs are limited to a few toxic compounds, with some parasite strains developing resistance. Therefore, the discovery and development of a new anti-leishmanial compound is crucial. One promising strategy involves the use of nanoparticle delivery systems to accelerate the effectiveness of existing treatments. In this study, Amphotericin B (AmB) was incorporated into functionalized carbon nanotube (f-CNT) and evaluated for its efficacy against Leishmania major in vitro and in a BALB/c mice model. The increase in footpad thickness was measured, and real-time PCR was used to quantify the parasite load post-infection. Levels of nitric oxide and cytokines IL-4 and IFN-γ were also determined. We found that f-CNT-AmB significantly reduced the levels of promastigotes and amastigotes of the Leishmania parasite. The nanoparticle showed strong anti-leishmanial activity with an IC50 of 0.00494 ± 0.00095 mg/mL for promastigotes and EC50 of 0.00294 ± 0.00065 mg/mL for amastigotes at 72 h post-infection, without causing harm to mice macrophages. Treatment of infected BALB/c mice with f-CNT-AmB resulted in a significant decrease in cutaneous leishmania (CL) lesion size in the foot pad, as well as reduced Leishmania burden in both lymph nodes and spleen. The levels of nitric oxide and IFN-γ significantly increased in the f-CNT-AmB treated groups. Also, our results showed that the level of IL-4 significantly decreased after f-CNT-AmB treatment in comparison to other groups. In conclusion, our results demonstrate that AmB loaded into f-CNT is significantly more effective than AmB alone in inhibiting parasite propagation and promoting a shift towards a Th1 response.
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Anfotericina B , Antiprotozoarios , Leishmania major , Leishmaniasis Cutánea , Ratones Endogámicos BALB C , Carga de Parásitos , Animales , Leishmaniasis Cutánea/tratamiento farmacológico , Leishmaniasis Cutánea/parasitología , Anfotericina B/administración & dosificación , Anfotericina B/farmacología , Anfotericina B/uso terapéutico , Leishmania major/efectos de los fármacos , Ratones , Antiprotozoarios/farmacología , Antiprotozoarios/administración & dosificación , Antiprotozoarios/uso terapéutico , Femenino , Nanopartículas , Interleucina-4/metabolismo , Óxido Nítrico/metabolismo , Modelos Animales de Enfermedad , Nanotubos de Carbono/química , Interferón gamma , Concentración 50 InhibidoraRESUMEN
While Pt is highly efficient for hydrogen evolution reaction (HER), its widespread use is limited by scarcity and high cost. Herein, a vertically aligned electrocatalyst is present comprising Ni3S2 nanotube arrays (NTAs) and Ni nanoparticles (NPs) (Ni3S2/Ni NTAs) for neutral HER. In a neutral 4 wt.% NaCl solution (pH = 7), the Ni3S2/Ni NTAs achieves a current density of 100 mA cm-2 at a low overpotential of 540 mV, outperforming both Ni3S2 NTAs and Ni NTAs and even the commercial Pt plate. The hollow tubular structure offers ample mass transfer channels, and strong electronic interaction between Ni3S2 and Ni is observed. Theoretical studies reveal that the lowered d-band center (Éd) of Ni 3d orbital significantly reduces the activation energy for H2O dissociation and facilitates the movement of an H atom in H2O away from OH to form a transition state, consequently promoting H2 evolution. When Ni3S2/Ni NTAs is used as the cathode in a two-electrode diaphragm-free electrolyzer with a RuSnTi anode, efficient H2 production and energy-saving Cl2 evolution are achieved. This work highlights the potential of uniquely structured electrocatalysts for HER in neutral NaCl solutions.