Search results for "Spectroscopy"

showing 10 items of 10293 documents

Characterization of Thin Passive Film-Electrolyte Junctions.The Amorphous Semiconductor (a-SC) Schottky Barrier Approach

2016

The knowledge of the solid-state properties of passive film is a preliminary task for a full understanding of the electron and ion transfer processes at the metal/oxide and oxide/electrolyte interface. Both processes are of paramount importance in determining the mechanism of film growth and dissolution as well as in determining the nature of the breakdown during the growth of anodic oxide films or the onset of generalized or localized corrosion process (1-2). With very few exceptions, it is a common belief, that most of anodic oxide films, grown on metals and alloys in aqueous solutions, display a semiconducting or insulating behaviour. It is also very well known that in many cases the ini…

Settore ING-IND/23 - Chimica Fisica ApplicataThin Passive Films Electrochemical Impedance Spectroscopy Amorphous Semiconductor (a-SC) Schottky Barrier Theory Corrosion Passivity
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Tuning of solid state properties of Al-Ta mixed oxides

2014

Settore ING-IND/23 - Chimica Fisica Applicatasolid state properties Al-Ta mixed oxides Photoelectrochemistry Electrochemical Impedance Spectroscopy
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A critical analysis of the theory of amorphous semiconductor Schottky barrier for oxides

2014

Settore ING-IND/23 - Chimica Fisica Applicatatheory of amorphous semiconductor Schottky barrier oxides electrochemical impedance spectroscopy
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Nanostructured anatase TiO2 densified at high pressure as advanced visible light photocatalysts

2015

This study reports on characterization and photoactivity of nanostructured TiO2 samples, which have been permanently densified under high pressures, up to 2.1 GPa. Commercial Mirkat 211 anatase has been used as a benchmark sample, in order to investigate the effect of unidirectional high pressure on structural, optical and photocatalytic properties of TiO2. Vibrational Raman spectroscopy shows that the treatment does not cause transitions among the different crystalline phases of titanium dioxide. UV-vis diffuse reflectance spectra reveal that increasing pressure gives rise to a shift of the absorption onset towards higher wavelength enhancing the photoactivity under visible radiation. Samp…

Settore ING-IND/24 - Principi Di Ingegneria ChimicaAnataseMaterials scienceMineralogysymbols.namesakechemistry.chemical_compoundchemistryChemical engineeringTitanium dioxidePhotocatalysissymbolsPhotocatalysis Anatase Densified TiO2IrradiationPartial oxidationPhotocatalysisPhysical and Theoretical ChemistryAbsorption (electromagnetic radiation)Raman spectroscopyVisible spectrumPhotochemical & Photobiological Sciences
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N-Doped Anatase/Rutile Photocatalysts for the Synthesis of Aromatic Aldehydes Under Ultraviolet and Solar Irradiation

2015

N-doped anatase/rutile photocatalysts were prepared by a sol-gel method, using TiCl4 as TiO2 precursor and urea as N-dopant source. The catalysts required a thermal treatment at temperature higher than 300 degrees C to achieve actual nitrogen doping; this treatment also allowed obtaining crystalline and hydrophobic samples. Moreover, nitrogen doping modified the surface of samples by increasing the anatase to rutile phase ratio and hydrophilicity. The catalysts were characterized by BET specific surface area, XRD, ESEM, TGA, FT-IR, DRS and XPS measurements, with particular attention to the assessment of the N-doping effect. It was found that XPS analysis should be used together with DRS and…

Settore ING-IND/24 - Principi Di Ingegneria ChimicaAnataseMaterials scienceN-Doped TiO2 Photocatalysis Solar Irradiation Green Synthesis p-Anisaldehyde X-ray Photoelectron SpectroscopyInorganic chemistryDopingPhotochemistrymedicine.disease_causeSettore CHIM/03 - Chimica Generale E InorganicaRutilemedicineGeneral Materials ScienceIrradiationUltravioletScience of Advanced Materials
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EMBER—Embedding Multiple Molecular Fingerprints for Virtual Screening

2022

In recent years, the debate in the field of applications of Deep Learning to Virtual Screening has focused on the use of neural embeddings with respect to classical descriptors in order to encode both structural and physical properties of ligands and/or targets. The attention on embeddings with the increasing use of Graph Neural Networks aimed at overcoming molecular fingerprints that are short range embeddings for atomic neighborhoods. Here, we present EMBER, a novel molecular embedding made by seven molecular fingerprints arranged as different “spectra” to describe the same molecule, and we prove its effectiveness by using deep convolutional architecture that assesses ligands&…

Settore ING-INF/05 - Sistemi Di Elaborazione Delle InformazioniBinding SitesMolecular StructureDeep learning Drug design Embedding Virtual screeningResearchOrganic ChemistryGeneral MedicineLigandsCatalysisComputer Science ApplicationsInorganic ChemistryCDC2 Protein KinaseDrug DiscoveryMass Screeningdeep learning; drug design; virtual screening; embeddingNeural Networks ComputerPhysical and Theoretical ChemistryProtein KinasesMolecular BiologySpectroscopy
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How Can We Improve the Vaccination Response in Older People? Part II: Targeting Immunosenescence of Adaptive Immunity Cells.

2022

The number of people that are 65 years old or older has been increasing due to the improvement in medicine and public health. However, this trend is not accompanied by an increase in quality of life, and this population is vulnerable to most illnesses, especially to infectious diseases. Vaccination is the best strategy to prevent this fact, but older people present a less efficient response, as their immune system is weaker due mainly to a phenomenon known as immunosenescence. The adaptive immune system is constituted by two types of lymphocytes, T and B cells, and the function and fitness of these cell populations are affected during ageing. Here, we review the impact of ageing on T and B …

Settore MED/04 - Patologia GeneraleB cellAgingImmunosenescenceOrganic ChemistryVaccinationT cellGeneral MedicinevaccinesAdaptive ImmunityCatalysisComputer Science ApplicationsInorganic ChemistryQuality of LifeHumansPhysical and Theoretical ChemistryMolecular BiologySpectroscopyAgedInternational journal of molecular sciences
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Effects of Oleuropein and Hydroxytyrosol on Inflammatory Mediators: Consequences on Inflammaging

2022

Aging is associated with a low-grade, systemic inflammatory state defined as “inflammaging”, ruled by the loss of proper regulation of the immune system leading to the accumulation of pro-inflammatory mediators. Such a condition is closely connected to an increased risk of developing chronic diseases. A number of studies demonstrate that olive oil phenolic compound oleuropein and its derivative hydroxytyrosol contribute to modulating tissue inflammation and oxidative stress, thus becoming attractive potential candidates to be used in the context of nutraceutical interventions, in order to ameliorate systemic inflammation in aging subjects. In this review, we aim to summarize the available d…

Settore MED/04 - Patologia GeneraleInorganic ChemistryoleuropeinOrganic ChemistryinflammagingnutraceuticalGeneral MedicinePhysical and Theoretical ChemistryMolecular BiologyhydroxytyrosolSpectroscopyCatalysisComputer Science ApplicationsInternational Journal of Molecular Sciences
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Distribution of KIR Genes and Their HLA Ligands in Different Viral Infectious Diseases: Frequency Study in Sicilian Population

2022

Natural killer (NK) cells play a role in defence against viral infections by killing infected cells or by producing cytokines and interacting with adaptive immune cells. Killer immunoglobulin-like receptors (KIRs) regulate the activation of NK cells through their interaction with human leucocyte antigens (HLA). Ninety-six Sicilian patients positive to Human Immunodeficiency Virus-1 (HIV) and ninety-two Sicilian patients positive to SARS-CoV-2 were genotyped for KIRs and their HLA ligands. We also included fifty-six Sicilian patients with chronic hepatitis B (CHB) already recruited in our previous study. The aim of this study was to compare the distribution of KIR–HLA genes/groups of these t…

Settore MED/04 - Patologia GeneraleKIR gene; HLA; Sicilian population; COVID-19; HIV; HBVOrganic ChemistryCOVID-19HIVSicilian populationGeneral MedicineCatalysisComputer Science ApplicationsHLAInorganic ChemistryHBVKIR genePhysical and Theoretical ChemistryMolecular BiologySpectroscopyInternational Journal of Molecular Sciences
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How Important Are Genes to Achieve Longevity?

2022

Several studies on the genetics of longevity have been reviewed in this paper. The results show that, despite efforts and new technologies, only two genes, APOE and FOXO3A, involved in the protection of cardiovascular diseases, have been shown to be associated with longevity in nearly all studies. This happens because the genetic determinants of longevity are dynamic and depend on the environmental history of a given population. In fact, population-specific genes are thought to play a greater role in the attainment of longevity than those shared between different populations. Hence, it is not surprising that GWAS replicated associations of common variants with longevity have been few, if an…

Settore MED/04 - Patologia Generalelong-life familiesOrganic ChemistryLongevitySNPGeneral MedicinesurvivalCatalysisComputer Science ApplicationsInorganic ChemistryHealthy AgingGenetics PopulationPhenotypeGWASFOXO3APhysical and Theoretical ChemistrygenesMolecular BiologyAPOESpectroscopyInternational journal of molecular sciences
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