Search Results - "Fávero, P.P."
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DFT application for chlorin derivatives photosensitizer drugs modeling
Published in Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy (15-04-2018)“…Photodynamic therapy is an alternative form of cancer treatment that meets the desire for a less aggressive approach to the body. It is based on the…”
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Assessment of penetration of Ascorbyl Tetraisopalmitate into biological membranes by molecular dynamics
Published in Computers in biology and medicine (01-08-2016)“…Abstract The present work, involves the simulation of the transport of a vitamin C derivative, Ascorbyl Tetraisopalmitate (ATI), through human skin by…”
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Surface enhanced Raman scattering, electronic spectrum and Mulliken charge distribution in the normal modes of bis(diethyldithiocarbamate)zinc(II) complex
Published in Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy (01-06-2013)“…[Display omitted] •SERS for [Zn(DDTC)2] complex was obtained on nano-structured silver surface.•Electronic spectrum was measured and charge transfer bands (CT)…”
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Confocal Raman spectroscopy as a tool to assess advanced glycation end products on solar-exposed human skin
Published in Vibrational spectroscopy (01-05-2021)“…[Display omitted] Advanced glycation end products (AGEs) consist of a complex and heterogeneous class of compounds frequently associated with the skin aging…”
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Phenylalanine ab initio models for the simulation of skin natural moisturizing factor
Published in Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy (01-04-2013)“…[Display omitted] ► Gas phase phenylalanine model. ► Solvated phenylalanine model. ► Vibrational modes: comparison of theoretical and experimental values. ►…”
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Driving forces for the adsorption of cyclopentene on InP(001)
Published in Surface science (01-04-2011)“…In this work the interaction of cyclopentene with a set of InP(001) surfaces is investigated by means of the density functional theory. We propose a simple…”
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EL2 model based on indications of an intermediate metastable state
Published in Physica. B, Condensed matter (01-04-2006)“…By the use of a transmittance experiment with a λ = 1.05 μ m (1.18 eV) laser beam we study the EL2 kinetics as a function of sample temperature. The…”
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