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1.
Waste Manag ; 175: 315-327, 2024 Mar 01.
Artigo em Inglês | MEDLINE | ID: mdl-38237407

RESUMO

The study presents an innovative approach to the analysis of waste silicon photovoltaic panels prior and after thermal treatment. Using laser-induced breakdown spectroscopy (LIBS), the elemental composition of multilayered panel backsheets was determined, identifying a TiO2-containing coating laminate, a polyvinylidene fluoride (PVDF) layer, and an ethylene vinyl acetate (EVA) encapsulant, while also estimating their thickness. Identifying the fluorine-containing layers allowed their selective removal and safe processing of the used panels. Thermal processing parameters such as temperature (400-550 °C), time (5 - 60 min) and orientation of the busbar relative to the heat source were optimized based on contact angle measurements and CIELAB color space analysis, techniques used to detect organic residues in recovered glass and silicone. The decomposition process was examined by thermal analysis coupled with mass spectroscopy, which revealed that there were no volatile fluorine compounds in the gases released, although fluorine was detected on the recovered glass surface by SEM - EDS examination. After the PVDF layer was removed, fluorine compounds were not found in volatile gases or on the surface of recovered inorganic materials. The study indicated that the orientation of the busbars facilitates the decomposition of organic matter. Methods for reusing recovered secondary materials were also provided, suggesting the potential applications and benefits of recycling components from silicon photovoltaic panels.


Assuntos
Compostos de Flúor , Polímeros de Fluorcarboneto , Polivinil , Silício , Silício/química , Flúor , Gases
2.
Anal Chem ; 94(18): 6672-6680, 2022 05 10.
Artigo em Inglês | MEDLINE | ID: mdl-35475623

RESUMO

Silicon (Si) is promising as a field enhancement material because of its high abundance, low toxicity, and high refractive index. The field enhancement effect intensifies light-matter interactions, which improves photocatalysis, solar cell performance, and sensor sensitivity. To manufacture field enhancement materials on a production scale, the fabrication technique must be simple, cost-effective, fast, and highly reproducible and must produce a high enhancement factor (EF). Herein, we report on an economical and efficient fabrication method for a field enhancement substrate consisting of a two-dimensional Si wire array (2D-SiWA). This substrate was demonstrated as a fluorescence sensor with high sensitivity (EF > 200) and composed of a large area (6.0 mm2). In addition, single wire spectroscopy was used to identify very high reproducibility of the sensor sensitivity in regular regions (97%) and a mixture of regular and irregular regions (87%) of the 2D-SiWA. The large-area Si fluorescence sensor fabrication was cost-effective and rapid and was 50× less expensive, 20×faster, and 60,000×larger than the typical electron beam lithography method.


Assuntos
Refratometria , Silício , Reprodutibilidade dos Testes , Silício/química , Análise Espectral
3.
J Phys Chem Lett ; 11(14): 5655-5660, 2020 Jul 16.
Artigo em Inglês | MEDLINE | ID: mdl-32453582

RESUMO

Theoretical models aimed at describing magic-angle-spinning (MAS) dynamic nuclear polarization (DNP) NMR have great potential in facilitating the in silico design of DNP polarizing agents and formulations. These models must typically face a trade-off between the accuracy of a strict quantum mechanical description and the need for using realistically large spin systems, for instance, using phenomenological models. Here, we show that the use of aggressive state-space restrictions and an optimization strategy allows full-scale ab initio MAS-DNP simulations of spin systems containing thousands of nuclei. Our simulations are shown to reproduce experimental DNP enhancements quantitatively, including their MAS rate dependence, for both frozen solutions and solid materials. They also reveal the importance of a previously unrecognized structural feature found in some polarizing agents that helps minimize the sensitivity losses imposed by the spin diffusion barrier.


Assuntos
Simulação por Computador , Modelos Químicos , Espectroscopia de Prótons por Ressonância Magnética , Hidrogênio/química , Isótopos/química , Simulação de Dinâmica Molecular , Método de Monte Carlo , Silício/química
4.
Appl Opt ; 59(5): A167-A175, 2020 Feb 10.
Artigo em Inglês | MEDLINE | ID: mdl-32225370

RESUMO

Hyperspectral imaging for agricultural applications provides a solution for non-destructive, large-area crop monitoring. However, current products are bulky and expensive due to complicated optics and electronics. A linear variable filter was developed for implementation into a prototype hyperspectral imaging camera that demonstrates good spectral performance between 450 and 900 nm. Equipped with a feature extraction and classification algorithm, the proposed system can be used to determine potato plant health with ∼88% accuracy. This algorithm was also capable of species identification and is demonstrated as being capable of differentiating between rocket, lettuce, and spinach. Results are promising for an entry-level, low-cost hyperspectral imaging solution for agriculture applications.


Assuntos
Produtos Agrícolas/metabolismo , Imageamento Hiperespectral/instrumentação , Imageamento Hiperespectral/métodos , Dispositivos Ópticos/economia , Folhas de Planta/metabolismo , Algoritmos , Técnicas Biossensoriais/instrumentação , Técnicas Biossensoriais/métodos , Calibragem , Luz , Membranas Artificiais , Micro-Ondas , Nióbio/química , Óxidos/química , Oxigênio/química , Gases em Plasma/química , Refratometria , Silício/química , Análise Espectral , Propriedades de Superfície
5.
Food Chem ; 324: 126893, 2020 Sep 15.
Artigo em Inglês | MEDLINE | ID: mdl-32344336

RESUMO

An Au patch electrode Ag-SnO2/SiO2/Si MIS capacitive sensor equipped with a microcontroller was designed and developed to sense low concentration (ppb to ppm regime) of volatiles (NH3, TMA, ethanol, and H2S) generated from chicken meat spoilage at room temperature. The quality threshold or the acceptance limit for consumption of chicken meat samples stored at 4 °C, 15 °C and 25 °C using our proposed technique was found to be 105 h, 48 h, and 17 h respectively, highly correlated with TVB-N, TVC, pH and sensory evaluation analysis. When these well established standard methods (TVB-N, TVC and pH analysis) take many hours to complete the analysis involving many complicated steps, our fabricated sensor takes 55 sec to deliver sensing response reflecting the meat spoilage status. The sensor calibrated with our compact technique promises portable and inexpensive onsite rapid and accurate quality assessment of meat spoilage at room temperature.


Assuntos
Gases/análise , Ouro/química , Carne/análise , Semicondutores , Amônia/análise , Animais , Galinhas , Eletrodos , Qualidade dos Alimentos , Sulfeto de Hidrogênio/análise , Concentração de Íons de Hidrogênio , Silício/química , Dióxido de Silício/química , Prata/química , Temperatura , Compostos de Estanho/química
6.
J Radiat Res ; 61(3): 410-418, 2020 May 22.
Artigo em Inglês | MEDLINE | ID: mdl-32211851

RESUMO

This study characterized a new unshielded diode detector, the microSilicon (model 60023), for small-field photon beam dosimetry by evaluating the photon beams generated by a TrueBeam STx and a CyberKnife. Temperature dependence was evaluated by irradiating photons and increasing the water temperature from 11.5 to 31.3°C. For Diode E, microSilicon, microDiamond and EDGE detectors, dose linearity, dose rate dependence, energy dependence, percent-depth-dose (PDD), beam profiles and detector output factor (OFdet) were evaluated. The OFdet of the microSilicon detector was compared to the field output factors of the other detectors. The microSilicon exhibited small temperature dependence within 0.4%, although the Diode E showed a linear variation with a ratio of 0.26%/°C. The Diode E and EDGE detectors showed positive correlations between the detector reading and dose rate, whereas the microSilicon showed a stable response within 0.11%. The Diode E and microSilicon demonstrated negative correlations with the beam energy. The OFdet of microSilicon was the smallest among all the detectors. The maximum differences between the OFdet of microSilicon and the field output factors of microDiamond were 2.3 and 1.6% for 5 × 5 mm2 TrueBeam and 5 mm φ CyberKnife beams, respectively. The PDD data exhibited small variations in the dose fall-off region. The microSilicon and microDiamond detectors yielded similar penumbra widths, whereas the other detectors showed steeper penumbra profiles. The microSilicon demonstrated favorable characteristics including small temperature and dose rate dependence as well as the small spatial resolution and output factors suitable for small field dosimetry.


Assuntos
Fótons , Radiometria/instrumentação , Planejamento da Radioterapia Assistida por Computador/instrumentação , Silício/química , Relação Dose-Resposta à Radiação , Humanos , Método de Monte Carlo , Aceleradores de Partículas , Imagens de Fantasmas , Radiocirurgia/instrumentação , Espalhamento de Radiação , Temperatura
7.
Phys Med Biol ; 65(1): 01NT01, 2020 01 13.
Artigo em Inglês | MEDLINE | ID: mdl-31829983

RESUMO

The PTW 60023 microSilicon is a new unshielded diode detector for small-field photon dosimetry. It provides improved water equivalence and a slightly larger sensitive region diameter in comparison to previous diode detectors in this range. In this study we evaluated the correction factors relevant to commissioning a CyberKnife System with this detector by Monte Carlo simulation and verified this data by multi-detector measurement comparison. The correction factors required for output factor determination were substantially closer to unity at small field sizes than for previous diode versions (e.g. [Formula: see text] = 0.981 at 5 mm field size which compares with corrections of 5%-6% with other stereotactic diodes). Because of these differences we recommend that corrections to small field output factor measurements generated specifically for the microSilicon detector rather than generic data taken from other diode types should be used with this new detector. For depth-dose measurements the microSilicon is consistent with a microDiamond detector to <1% (global), except at depths <10 mm where the diode gives a significantly lower measurement, by 6%-8% at the surface. For profile measurements, the microSilicon requires negligible corrections except in the low dose region outside the beam, where it underestimates off-axis-ratio (OAR) for small fields and overestimates for large fields. Where this effect is most noticeable at the largest field size and depth (115 mm × 100 mm and 300 mm depth) the microSilicon overestimates OAR by 2.3% (global) in the profile tail. This is consistent with other unshielded diodes.


Assuntos
Algoritmos , Aceleradores de Partículas/instrumentação , Imagens de Fantasmas , Radiometria/instrumentação , Radiocirurgia/instrumentação , Silício/química , Humanos , Método de Monte Carlo , Fótons , Radiometria/métodos , Radiocirurgia/métodos , Água/química
8.
Chemosphere ; 244: 125481, 2020 Apr.
Artigo em Inglês | MEDLINE | ID: mdl-31812047

RESUMO

Cadmium (Cd) contamination of arable soils and its subsequent accumulation in food is one of the global issues which needs urgent attention. Field experiments were conducted to explore the impacts of ten silicon (Si) rich amendments on Cd bioavailability and accumulation by maize and wheat irrigated with sewage effluents. Results depicted that applied amendments decreased the total Cd accumulation in shoots and grains of both crops with and the maximum decrease was observed in rice husk biochar (RHB) treatment. The RHB was able to significantly decrease the translocation factor, Cd harvest and health risk indexes. All amendments differentially affected the soil pH, EC, CaCl2-extractable Si, and decreased the AB-DTPA-extractable soil Cd. Overall, suitable Si rich amendments (like RHB and CSB etc.) can be employed to mitigate the health risks associated with dietary Cd in untreated sewage irrigated fields. However, the cost-benefit analysis such Si rich amendments should be considered before final recommendations.


Assuntos
Agricultura/métodos , Cádmio/análise , Grão Comestível/química , Fertilizantes/análise , Medição de Risco , Silício/química , Poluentes do Solo/análise , Disponibilidade Biológica , Carvão Vegetal , Produtos Agrícolas , Oryza/crescimento & desenvolvimento , Solo , Triticum/crescimento & desenvolvimento
9.
Phys Med Biol ; 65(3): 035004, 2020 01 24.
Artigo em Inglês | MEDLINE | ID: mdl-31842007

RESUMO

Compact silicon on insulator (SOI) microdosimeters have been used to characterise the radiation field of many different hadron therapy beams. SOI devices are particularly attractive in hadron therapy fields due to their spatial resolution being well suited to the sharp dose gradients at the end of the primary beam's range. Due to the small size of SOI's sensitive volumes (SVs), which are usually ∼1-10 [Formula: see text]m thick, the fabrication of these devices can present challenges which are not as common for more conventional thickness silicon devices such as silicon spectroscopy detectors. Microdosimetry is the study of the energy deposition in micrometre sized volumes representing biological sites and is a powerful approach to estimate the biological effect of radiation on the micron-scale level, in a cell. However, cell sizes vary extensively translating in different energy deposition spectra. This work studies SV thicknesses between 1 and 100 [Formula: see text]m using Geant4 and examines the impact of SV dimensions on microdosimetric quantities. The quantities studied were the frequency mean lineal energy, [Formula: see text], and the dose mean lineal energy, [Formula: see text]. Additionally the relative biological effectiveness (RBE), estimated by the microdosimetric kinetic model (MKM), is also investigated. To study the impact of the SV thickness, SOI microdosimeters were irradiated with proton, [Formula: see text] and [Formula: see text] ion beams with ranges of ∼160 mm, with the microdosimeter being set at various positions along the Bragg curve. It was found that [Formula: see text] was influenced the least in proton beams and increased for heavier ion beams. Conversely, [Formula: see text] was impacted by the SV thickness the most in proton beams and [Formula: see text] was the least. Similar to [Formula: see text], protons were impacted the most by the SV thickness when estimating the RBE using the MKM. The cause of these differences was largely due to the different densities of the delta electron track structure for the case of [Formula: see text] and the energy transferred to the medium from the primary beam for [Formula: see text].


Assuntos
Imagens de Fantasmas , Radiometria/instrumentação , Silício/química , Humanos , Cinética , Método de Monte Carlo , Prótons , Radiometria/métodos , Eficiência Biológica Relativa
10.
Int J Mol Sci ; 20(21)2019 Oct 29.
Artigo em Inglês | MEDLINE | ID: mdl-31671776

RESUMO

A set of 25 novel, silicon-based carbamate derivatives as potential acetyl- and butyrylcholinesterase (AChE/BChE) inhibitors was synthesized and characterized by their in vitro inhibition profiles and the selectivity indexes (SIs). The prepared compounds were also tested for their inhibition potential on photosynthetic electron transport (PET) in spinach (Spinacia oleracea L.) chloroplasts. In fact, some of the newly prepared molecules revealed comparable or even better inhibitory activities compared to the marketed drugs (rivastigmine or galanthamine) and commercially applied pesticide Diuron®, respectively. Generally, most compounds exhibited better inhibition potency towards AChE; however, a wider activity span was observed for BChE. Notably, benzyl N-[(1S)-2-[(tert-butyldimethylsilyl)oxy]-1-[(2-hydroxyphenyl)carbamoyl]ethyl]-carbamate (2) and benzyl N-[(1S)-2-[(tert-butyldimethylsilyl)oxy]-1-[(3-hydroxyphenyl)carbamoyl]ethyl]-carbamate (3) were characterized by fairly high selective indexes. Specifically, compound 2 was prescribed with the lowest IC50 value that corresponds quite well with galanthamine inhibition activity, while the inhibitory profiles of molecules 3 and benzyl-N-[(1S)-2-[(tert-butyldimethylsilyl)oxy]-1-[(4-hydroxyphenyl)carbamoyl]ethyl]carbamate (4) are in line with rivastigmine activity. Moreover, a structure-activity relationship (SAR)-driven similarity evaluation of the physicochemical properties for the carbamates examined appeared to have foreseen the activity cliffs using a similarity-activity landscape index for BChE inhibitory response values. The 'indirect' ligand-based and 'direct' protein-mediated in silico approaches were applied to specify electronic/steric/lipophilic factors that are potentially valid for quantitative (Q)SAR modeling of the carbamate analogues. The stochastic model validation was used to generate an 'average' 3D-QSAR pharmacophore pattern. Finally, the target-oriented molecular docking was employed to (re)arrange the spatial distribution of the ligand property space for BChE and photosystem II (PSII).


Assuntos
Carbamatos/química , Carbamatos/farmacologia , Inibidores da Colinesterase/química , Silício/química , Sítios de Ligação , Butirilcolinesterase , Sobrevivência Celular/efeitos dos fármacos , Cloroplastos , Inibidores da Colinesterase/farmacologia , Transporte de Elétrons/efeitos dos fármacos , Humanos , Concentração Inibidora 50 , Ligantes , Simulação de Acoplamento Molecular , Complexo de Proteína do Fotossistema II , Spinacia oleracea , Relação Estrutura-Atividade , Células THP-1/efeitos dos fármacos
11.
PLoS One ; 14(8): e0221043, 2019.
Artigo em Inglês | MEDLINE | ID: mdl-31442246

RESUMO

As the traditional IC design migrates to three-dimensional integrated circuits (3D-ICs) design, new challenges need to be considered carefully to solve its reliability and yield issues. 3D-ICs using through-silicon-vias (TSVs) can have latent defects such as resistive open and bridge defects, which are caused by the thermal stress during the fabrication process. These latent defects lead to the deterioration of the electrical performance of TSVs caused by an undesired increase in the resistance-capacitance (RC) delay. For this reason, various post-bond test methodologies have been studied to improve the reliability of 3D-ICs. Cost reduction in these TSV test architectures is also currently being studied by decreasing various factors such as hardware overhead, test time, and the peak current consumption. Usually, a single test-clock-period is required to determine whether the test result contains the defective TSV. When the test result of any TSVs fails, we use another single test-clock-period to classify its defect type. In this paper, we propose a new TSV test architecture to transfer the combined test output of the test result and the specific defect type to the pad during the single test-clock-period. Our proposed test architecture also provides a reliable block-based concurrent testing to optimize the test time by dividing the die into concurrent blocks. The experimental results showed that our proposed test architecture could reduce the test time and the hardware overhead substantially by ensuring that the reasonable peak power consumption for mass production was reasonable without the test quality being adversely affected.


Assuntos
Eletrônica/métodos , Semicondutores , Silício/química , Algoritmos , Desenho de Equipamento , Processamento de Sinais Assistido por Computador
12.
Radiol Phys Technol ; 12(3): 325-334, 2019 Sep.
Artigo em Inglês | MEDLINE | ID: mdl-31385155

RESUMO

Recent studies have shown that the particle size of the shielding material and photon energy has significant effects on the efficiency of radiation-shielding materials. The purpose of the current study was to investigate the shielding properties of the bismuth-silicon (Bi-Si) composite containing varying percentages of micro- and nano-sized Bi particles for low-energy X-rays. Radiation composite shields composed of nano- and micro-sized Bi particles in Si-based matrix were constructed. The mass attenuation coefficients of the designed shields were experimentally assessed for diagnostic radiology energy range. In addition, the mass attenuation coefficients of the composite were comprehensively investigated using the MCNPX Monte Carlo (MC) code and XCOM. The X-ray attenuation for two different micro-sized Bi composites of radii of 50 µm and 0.50 µm showed enhancement in the range of 37-79% and 5-24%, respectively, for mono-energy photons (60-150 keV). Furthermore, the experimental and MC results indicated that nano-structured composites had higher photon attenuation properties (approximately 11-18%) than those of micro-sized samples for poly-energy X-ray photons. The amount of radiation attenuation for lower energies was more than that of higher energies. Thus, it was found that the shielding properties of composites were considerably strengthened by adding Bi nano-particles for lower energy photons.


Assuntos
Bismuto/química , Microesferas , Nanopartículas , Tamanho da Partícula , Fótons , Protetores contra Radiação/química , Silício/química , Modelos Moleculares , Conformação Molecular , Método de Monte Carlo , Radiologia
13.
Comput Math Methods Med ; 2019: 7853586, 2019.
Artigo em Inglês | MEDLINE | ID: mdl-31236128

RESUMO

A long-standing problem in tissue engineering is the biofabrication of perfusable tissue constructs that can be readily connected to the patient's vasculature. It was partially solved by three-dimensional (3D) printing of sacrificial material (e.g., hydrogel) strands: upon incorporation in another cell-laden hydrogel, the strands were removed, leaving behind perfusable channels. Their complexity, however, did not match that of the native vasculature. Here, we propose to use multicellular spheroids as a sacrificial material and investigate their potential benefits in the context of 3D bioprinting of cell aggregates and/or cell-laden hydrogels. Our study is based on computer simulations of postprinting cellular rearrangements. The computational model of the biological system is built on a cubic lattice, whereas its evolution is simulated using the Metropolis Monte Carlo algorithm. The simulations describe structural changes in three types of tissue constructs: a tube made of a single cell type, a tube made of two cell types, and a cell-laden hydrogel slab that incorporates a branching tube. In all three constructs, the lumen is obtained after the elimination of the sacrificial cell population. Our study suggests that sacrificial cell spheroids (sacrospheres) enable one to print tissue constructs outfitted with a finer and more complex network of channels than the ones obtained so far. Moreover, cellular interactions might give rise to a tissue microarchitecture that lies beyond the bioprinter's resolution. Although more expensive than inert materials, sacrificial cells have the potential to bring further progress towards the biofabrication of fully vascularized tissue substitutes.


Assuntos
Bioimpressão/métodos , Hidrogéis/química , Impressão Tridimensional , Esferoides Celulares/citologia , Engenharia Tecidual/métodos , Células 3T3 , Algoritmos , Animais , Carcinoma Pulmonar de Lewis/metabolismo , Simulação por Computador , Humanos , Nanopartículas Metálicas/química , Camundongos , Método de Monte Carlo , Perfusão , Silício/química , Alicerces Teciduais
14.
Molecules ; 24(12)2019 Jun 13.
Artigo em Inglês | MEDLINE | ID: mdl-31200538

RESUMO

Aptamers are artificial nucleic acid ligands identified and obtained from combinatorial libraries of synthetic nucleic acids through the in vitro process SELEX (systematic evolution of ligands by exponential enrichment). Aptamers are able to bind an ample range of non-nucleic acid targets with great specificity and affinity. Devices based on aptamers as bio-recognition elements open up a new generation of biosensors called aptasensors. This review focuses on some recent achievements in the design of advanced label-free optical aptasensors using porous silicon (PSi) as a transducer surface for the detection of pathogenic microorganisms and diagnostic molecules with high sensitivity, reliability and low limit of detection (LoD).


Assuntos
Aptâmeros de Nucleotídeos/química , Técnicas Biossensoriais , Porosidade , Reprodutibilidade dos Testes , Técnica de Seleção de Aptâmeros , Silício/química
16.
Appl Radiat Isot ; 147: 171-176, 2019 May.
Artigo em Inglês | MEDLINE | ID: mdl-30878779

RESUMO

The objective was to design a thin, flex card based personal dosemeter with low angular and energy dependence. It is based on silicon diodes that can measure the personal dose equivalent. Anisotropic conducting adhesive was used to connect the Si sensor to the flex card. Its intended use is for interventional radiology and after nuclear or radiological accidents, as it provides immediate detailed information about the dose rate to the wearer during shorter periods and integrates the dose rate during hours. It can be freely placed all over the body. By placing the dosemeter close to the eyes, it may be possible to estimate the personal dose equivalent as well as the dose at the lens of the eye.


Assuntos
Olho/efeitos da radiação , Doses de Radiação , Dosímetros de Radiação , Silício/química , Humanos , Método de Monte Carlo , Impressão Tridimensional , Proteção Radiológica/métodos , Radiologia Intervencionista
17.
Colloids Surf B Biointerfaces ; 173: 109-120, 2019 Jan 01.
Artigo em Inglês | MEDLINE | ID: mdl-30273871

RESUMO

Biologically safe Ti-based quaternary Ti-Nb-Zr-Si thin film metallic glass (TFMG) was fabricated by sputtering on Titanium alloy (Ti6Al4V or Ti alloy) substrates. A preliminary assessment regarding glass forming ability, thermal stability and corrosion behavior was performed. The amorphous nature of the film is evidenced from the X-ray Diffraction (XRD) and Transmission Electron Microscope (TEM) and Selected Area Electron Diffraction (SAED) patterns. Ion scattering spectroscopy (ISS) and X-ray Photoelectron Spectroscopy (XPS) were used to analyse the chemical composition of surface which indicated oxygen on the top surface of the film and confirms the presence of Ti, Nb, Si, Zr without any other impurities. The surface morphology of the film showed a smooth surface as observed from scanning electron microscope (SEM) and atomic force microscope (AFM) analysis. It is found that the TFMG can sustain in the body-fluid, exhibiting superior corrosion resistance and electrochemical stability than the bare titanium. The cytotoxicity studies with L929 fibroblast cells showed that coatings were graded as zero and non-cytotoxic in nature. No hemolysis was observed on the coated surface indicating a better hemocompatibility. Assay using SaOS-2 bone cells showed good growth on the coated surfaces. The calcium assay showed that the SaOS-2 cells grown and differentiated on the control (Tissue Culture Polystyrene) TCPS surface had the highest mineral level. Higher alkaline phosphatase activity is obtained in SaOS-2 osteoblast cell cultures on TFMG than the control.


Assuntos
Ligas/farmacologia , Diferenciação Celular/efeitos dos fármacos , Materiais Revestidos Biocompatíveis/farmacologia , Osteoblastos/efeitos dos fármacos , Alicerces Teciduais , Fosfatase Alcalina/metabolismo , Ligas/química , Animais , Biomarcadores/metabolismo , Linhagem Celular , Linhagem Celular Tumoral , Materiais Revestidos Biocompatíveis/química , Eritrócitos/efeitos dos fármacos , Fibroblastos/citologia , Fibroblastos/efeitos dos fármacos , Fibroblastos/metabolismo , Humanos , Camundongos , Nióbio/química , Nióbio/farmacologia , Osteoblastos/citologia , Osteoblastos/metabolismo , Silício/química , Silício/farmacologia , Propriedades de Superfície , Titânio/química , Titânio/farmacologia , Zircônio/química , Zircônio/farmacologia
18.
J Chem Inf Model ; 58(12): 2414-2419, 2018 12 24.
Artigo em Inglês | MEDLINE | ID: mdl-30139249

RESUMO

Zeolites are important materials for research and industrial applications. Mesopores are often introduced by desilication but other properties are also affected, making its optimization difficult. In this work, we demonstrate that Perturbation Theory and Machine Learning can be combined in a PTML multioutput model describing the effects of desilication. The PTML model achieves a notable accuracy ( R2 = 0.98) in the external validation and can be useful for the rational design of novel materials.


Assuntos
Aprendizado de Máquina , Silício/química , Zeolitas/química , Simulação por Computador , Modelos Moleculares , Método de Monte Carlo , Propriedades de Superfície
19.
Anal Chem ; 90(15): 9559-9567, 2018 08 07.
Artigo em Inglês | MEDLINE | ID: mdl-29999303

RESUMO

A silicon-based miniaturized sensor chip combined with an advanced microfluidic module for the simultaneous, label-free immunochemical determination of four allergens, bovine milk protein, peanut protein, soy protein, and gliadin, is presented. The sensor chip consists of an array of 10 broad-band Mach-Zehnder interferometers (BB-MZIs) monolithically integrated on silicon, along with their respective broad-band light sources. The BB-MZIs were biofunctionalized with the targeted allergens and their responses during immunoreaction were monitored by multiplexing their transmission spectra through an external miniaturized spectrometer. The assay is performed by running mixtures of calibrators or samples with the antibodies against the four allergens followed by an antispecies specific antibodies solution. Employing a fluidic module of nearly one-dimensional geometry, that provided for uniform delivery of the reagents, CV values <6% were achieved for the responses of the 10 BB-MZIs, allowing for reliable multianalyte determinations. The analysis is completed in 6.5 min, and the detection limits were 0.04 µg/mL for bovine k-casein, 1.0 µg/mL for peanut protein, 0.80 µg/mL for soy protein, and 0.10 µg/mL for gliadin. The assays were accurate (recoveries 88-118%) and repeatable (intra- and interassay CVs <7% for all four allergens). Finally, the sensor was evaluated by analyzing samples from a cleaning in place system (CIP) of a dairy industry and the results obtained were in good agreement with those received by the respective ELISAs. The analytical characteristics of the sensor combined with the short analysis time and the small chip size make the proposed system an ideal tool for on-site multianalyte determinations.


Assuntos
Alérgenos/análise , Técnicas Biossensoriais/instrumentação , Interferometria/instrumentação , Silício/química , Animais , Arachis/química , Técnicas Biossensoriais/economia , Caseínas/análise , Bovinos , Análise de Alimentos/economia , Análise de Alimentos/instrumentação , Gliadina/análise , Interferometria/economia , Dispositivos Lab-On-A-Chip/economia , Limite de Detecção , Proteínas de Vegetais Comestíveis/análise , Proteínas de Soja/análise , Fatores de Tempo
20.
Radiat Prot Dosimetry ; 180(1-4): 372-376, 2018 Aug 01.
Artigo em Inglês | MEDLINE | ID: mdl-29309673

RESUMO

Neutron response functions of a thin silicon neutron sensor are simulated using PHITS2 and MCNP6 codes for an 8 MeV neutron beam at angles of incidence of 0°, 30° and 60°. The contributions of alpha particles created from the 28Si(n,α)25Mg reaction and the silicon nuclei scattered elastically by neutrons in the silicon sensor have not been well reproduced using the MCNP6 code. The 8 MeV neutron response functions simulated using the PHITS2 code with an accurate event generator mode are in good agreement with experimental results and include the contributions of the alpha particles and silicon nuclei.


Assuntos
Técnicas Biossensoriais/instrumentação , Técnicas Biossensoriais/métodos , Simulação por Computador , Nêutrons , Radiometria/métodos , Silício/química , Humanos , Método de Monte Carlo , Dosagem Radioterapêutica
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