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1.
J Mol Model ; 28(2): 42, 2022 Jan 25.
Artículo en Inglés | MEDLINE | ID: mdl-35076787

RESUMEN

Diabetes is a disease found in every 1 out of 4 people in the world. The glucose molecule is one of the sources of energy in the body and the lack of the digestion of glucose causes diabetes type 1 and type 2. Arginine and cysteine are nonessential amino acids that contain sulfur and help maintain the metabolisms of humans. We explored the glucose-arginine (Glc-arg) and glucose-cysteine (Glc-cys) molecules by finding their structural properties, electronic properties, chemical reactivity, mechanical strength, and transport properties because these non-essential amino acid molecules inhibit glucose-stimulated insulin secretion. Density functional theory (DFT) has been implemented to study all the properties of Glc-arg and Glc-cys using SIESTA software. Glucose-arginine (Glc-arg) inhibits a large percentage of glucose secretion and shows high chemical reactivity.


Asunto(s)
Aminoácidos , Glucemia , Diabetes Mellitus/dietoterapia , Diabetes Mellitus/metabolismo , Proteínas en la Dieta , Glucosa/metabolismo , Aminoácidos/química , Biomarcadores , Cisteína/análogos & derivados , Cisteína/sangre , Cisteína/química , Teoría Funcional de la Densidad , Diabetes Mellitus/sangre , Proteínas en la Dieta/administración & dosificación , Proteínas en la Dieta/química , Manejo de la Enfermedad , Glucosa/análogos & derivados , Glucosa/química , Humanos , Modelos Moleculares , Conformación Molecular , Estructura Molecular , Análisis Espectral , Resultado del Tratamiento
2.
Luminescence ; 32(3): 375-381, 2017 May.
Artículo en Inglés | MEDLINE | ID: mdl-28394484

RESUMEN

The present paper reports the thermoluminescence (TL) of (ZnS)1-x (MnTe)x nanophosphors that were prepared by a wet chemical synthesis method. The structure investigated by X-ray diffraction patterns confirms the formation of a sphalerite phase whose space group was found to be F 4¯3m. From XRD, TEM and SEM analyses the average sizes of the particles were found to be 12 nm, 11 nm and 15 nm, respectively. Initially the TL intensity increased with increasing values of x because the number of luminescence centres increased; however, for higher values of x the TL intensity decreased because of the concentration quenching. Thus the TL, mechanoluminescence and photoluminescence intensities are optimum for a particular value of x, that is for x = 0.05. Thermoluminescence of the (ZnS)1-x (MnTe)x nanophosphor has not been reported previously. There were two peaks seen in the thermoluminescence glow curves in which the first peak lay at 105-100 °C and the second peak lay at 183.5-178.5 °C. The activation energies for the first and second peaks were found to be 0.45 eV and 0.75 eV, respectively.


Asunto(s)
Luminiscencia , Nanopartículas/química , Sulfuros/química , Telurio/química , Temperatura , Compuestos de Zinc/química , Mediciones Luminiscentes , Tamaño de la Partícula , Propiedades de Superficie
3.
Luminescence ; 31(1): 67-75, 2016 Feb.
Artículo en Inglés | MEDLINE | ID: mdl-25991045

RESUMEN

Mathematical approaches made for both the charged dislocation model and piezoelectrically induced electron bombardment model of fracto-mechanoluminescence (FML), the luminescence induced by fracture of solids, in ZnS:Mn phosphor indicate that the piezoelectrically induced electron bombardment model provides a dominating process for the FML of ZnS phosphors. The concentration of 3000 ppm Mn(2+) is optimal for ML intensity of ZnS:Mn phosphor. The decay time of ML gives the relaxation time of the piston used to deform the sample and the time tm of maximum of ML is controlled by both the relaxation time of the piston and decay time of charges on the newly created surfaces of crystals. As the product of the velocity of dislocations and pinning time of dislocations gives the mean free path of a moving dislocation. Both factors play an important role in the ML excitation of impurity doped II-VI semiconductors. The linear increase of total ML intensity IT with the impact velocity indicates that the damage increases linearly with impact velocity of the load. Thus, the ML measurement can be used remotely to monitor the real-time damage in the structures, and therefore, the ML of ZnS:Mn phosphor has also the potential for a structural health monitoring system.


Asunto(s)
Luminiscencia , Manganeso/química , Sulfuros/química , Compuestos de Zinc/química
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