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1.
Pharmazie ; 76(2): 68-76, 2021 02 25.
Artigo em Inglês | MEDLINE | ID: mdl-33714282

RESUMO

Ocular toxoplasmosis is the major cause of infectious posterior uveitis worldwide, inducing visual field defect and/or blindness. Despite the severity of this disease, an effective treatment is still lacking. In this study, spiramycin-loaded PLGA implants were developed aiming at the treatment of ocular toxoplasmosis. Implants were manufactured by a hot-molding technique, characterized by Fourier Transform Infrared Spectroscopy, X-Ray Diffraction, Differential Scanning Calorimetry, Scanning Electron Microscopy; evaluated in terms of ocular biocompatibility by immunofluorescence, flow cytometry, cell migration, Hen's egg test-chorioallantoic membrane (HET-CAM) irritation test; and investigated in terms of in vitro efficacy against Toxoplasma gondii . Characterization techniques indicated that spiramycin was dispersed into the polymeric chains and both substances preserved their physical structures in implants. The HET-CAM test indicated that implants did not induce hemorrhage or coagulation, being non-irritant to the CAM. ARPE-19 cells showed viability by MTT assay, and normality in cell cycle kinetics and morphology, without stimulating cell death by apoptosis. Finally, they were highly effective against intracellular parasites without inducing human retinal pigment epithelial cell death. In conclusion, spiramycin-loaded PLGA implants represent a promising therapeutic alternative for the local treatment of ocular toxoplasmosis.


Assuntos
Sistemas de Liberação de Medicamentos/métodos , Copolímero de Ácido Poliláctico e Ácido Poliglicólico/química , Espiramicina/administração & dosagem , Toxoplasmose Ocular/tratamento farmacológico , Animais , Técnicas de Cultura de Células , Movimento Celular/efeitos dos fármacos , Sobrevivência Celular/efeitos dos fármacos , Galinhas , Membrana Corioalantoide , Células Epiteliais , Humanos , Microscopia Eletrônica de Varredura , Epitélio Pigmentado da Retina , Espiramicina/uso terapêutico , Toxoplasma/efeitos dos fármacos
2.
Biochim Biophys Acta Rev Cancer ; 1868(1): 333-340, 2017 Aug.
Artigo em Inglês | MEDLINE | ID: mdl-28554667

RESUMO

Glioblastoma, the most aggressive and fatal type of brain tumor, is capable of interacting with brain immune cells such as microglia, which contributes to the growth of these tumors. Various molecules, including growth factors and cytokines, have been identified as regulators of microglia-glioblastoma interaction. Recent studies suggest that the Wnt family of lipoglycoproteins plays an important role, not only in biological events during development, but also in cancer progression, and can be part of microglia recruitment to glioblastoma as well as of tumor growth and invasion. Here, we discuss recent interesting findings that support a role for Wnt signaling pathways in the microglia-glioblastoma crosstalk.


Assuntos
Neoplasias Encefálicas/metabolismo , Glioblastoma/metabolismo , Microglia/metabolismo , Via de Sinalização Wnt/fisiologia , Animais , Neoplasias Encefálicas/patologia , Citocinas/metabolismo , Glioblastoma/patologia , Humanos , Peptídeos e Proteínas de Sinalização Intercelular/metabolismo , Microglia/patologia
3.
J Chem Phys ; 151(12): 124306, 2019 Sep 28.
Artigo em Inglês | MEDLINE | ID: mdl-31575183

RESUMO

We report an experimental and theoretical investigation into the dynamics of electron-impact ionization of R-carvone. Experimental triple differential cross sections are obtained in asymmetric coplanar kinematic conditions for the ionization of the unresolved combination of the three outermost molecular orbitals (41a-39a) of R-carvone. These cross sections are compared with theoretical cross sections calculated within a molecular 3-body distorted wave (M3DW) framework employing either a proper orientation average or orbital average to account for the random orientation of the molecule probed in the experiment. Here, we observe that the overall scattering behavior observed in the experiment is fairly well reproduced within the M3DW framework when implementing the proper average over orientations. The character of the ionized orbitals also provides some qualitative explanation for the observed scattering behavior. This represents substantial progress when trying to describe the scattering dynamics observed for larger molecules under intermediate-impact energy and asymmetric energy sharing scattering conditions.

4.
J Chem Phys ; 150(19): 194307, 2019 May 21.
Artigo em Inglês | MEDLINE | ID: mdl-31117791

RESUMO

We report experimental measurements of the absolute total cross sections (TCSs) for electron scattering from 1-butanol at impact energies in the range 80-400 eV. Those measurements were conducted by considering the attenuation of a collimated electron beam, at a given energy, through a gas cell containing 1-butanol, at a given pressure, and through application of the Beer-Lambert law to derive the required TCS. We also report theoretical results using the Independent-Atom Model with Screening Corrected Additivity Rule and Interference approach. Those results include the TCS, the elastic integral cross section (ICS), the ionization total ICS, and the sum over all excitation process ICSs with agreement at the TCS level between our measured and calculated results being encouraging.

5.
Bull Entomol Res ; 109(3): 325-332, 2019 Jun.
Artigo em Inglês | MEDLINE | ID: mdl-29973304

RESUMO

Lipaphis erysimi (L.) Kaltenbach (Hemiptera: Aphididae) is one of the most important pests of brassica crops, mainly causing losses due to sap sucking, toxin injection and viral transmission. Knowledge about the main natural factors that regulate populations of this pest, as well as its critical mortality stage, is crucial for the development of integrated pest management of L. erysimi. Here, we determined the critical stage and key mortality factors for L. erysimi in cabbage using an ecological life table. Causes of mortality at each stage of L. erysimi development were monitored daily in the field for seven seasons. From the experimental data, we determined the key factor and critical stage of mortality through correlation and regression analyses. The nymphal stage, especially first instar nymphs, was critical for L. erysimi mortality. The key mortality factors were, in descending order of importance, physiological disturbances and predation by Syrphidae, Coccinellidae and Solenopsis ants. Therefore, control measures should target early stages of L. erysimi and the use of cabbage cultivars that have negative effects against L. erysimi may be a promising strategy for its management. Our results may be useful for plant geneticists who could develop new cabbage cultivars based on these findings. In addition, conservation measures of the main predators of L. erysimi may contribute to the natural control of this pest.


Assuntos
Afídeos/fisiologia , Brassica/parasitologia , Animais , Afídeos/crescimento & desenvolvimento , Afídeos/parasitologia , Brasil , Estágios do Ciclo de Vida , Tábuas de Vida , Dinâmica Populacional , Comportamento Predatório
6.
J Chem Phys ; 147(19): 194307, 2017 Nov 21.
Artigo em Inglês | MEDLINE | ID: mdl-29166110

RESUMO

Absolute total cross section (TCS) measurements for electron scattering from 1-propanol molecules are reported for impact energies from 40 to 500 eV. These measurements were obtained using a new apparatus developed at Juiz de Fora Federal University-Brazil, which is based on the measurement of the attenuation of a collimated electron beam through a gas cell containing the molecules to be studied at a given pressure. Besides these experimental measurements, we have also calculated TCS using the Independent-Atom Model with Screening Corrected Additivity Rule and Interference (IAM-SCAR+I) approach with the level of agreement between them being typically found to be very good.

7.
J Digit Imaging ; 30(2): 185-196, 2017 04.
Artigo em Inglês | MEDLINE | ID: mdl-27896452

RESUMO

Nowadays, the optimization in digital mammography is one of the most important challenges in diagnostic radiology. The new digital technology has introduced additional elements to be considered in this scenario. A major goal of mammography is related to the detection of structures on the order of micrometers (µm) and the need to distinguish the different types of tissues, with very close density values. The diagnosis in mammography faces the difficulty that the breast tissues and pathological findings have very close linear attenuation coefficients within the energy range used in mammography. The aim of this study was to develop a methodology for optimizing exposure parameters of digital mammography based on a new Figure of Merit: FOM ≡ (IQFinv)2/AGD, considering the image quality and dose. The study was conducted using the digital mammography Senographe DS/GE, and CDMAM and TORMAM phantoms. The characterization of clinical practice, carried out in the mammography system under study, was performed considering different breast thicknesses, the technical parameters of exposure, and processing options of images used by the equipment's automatic exposure system. The results showed a difference between the values of the optimized parameters and those ones chosen by the automatic system of the mammography unit, specifically for small breast. The optimized exposure parameters showed better results than those obtained by the automatic system of the mammography, for the image quality parameters and its impact on detection of breast structures when analyzed by radiologists.


Assuntos
Mama/diagnóstico por imagem , Mamografia/normas , Intensificação de Imagem Radiográfica , Adulto , Mama/anatomia & histologia , Feminino , Humanos , Mamografia/métodos , Pessoa de Meia-Idade , Tamanho do Órgão , Imagens de Fantasmas , Doses de Radiação
8.
J Chem Phys ; 144(12): 124309, 2016 Mar 28.
Artigo em Inglês | MEDLINE | ID: mdl-27036450

RESUMO

We report results from a joint experimental and theoretical investigation into electron scattering from the important industrial species furfural (C5H4O2). Specifically, differential cross sections (DCSs) have been measured and calculated for the electron-impact excitation of the electronic states of C5H4O2. The measurements were carried out at energies in the range 20-40 eV, and for scattered-electron angles between 10° and 90°. The energy resolution of those experiments was typically ∼80 meV. Corresponding Schwinger multichannel method with pseudo-potential calculations, for energies between 6-50 eV and with and without Born-closure, were also performed for a sub-set of the excited electronic-states that were accessed in the measurements. Those calculations were undertaken at the static exchange plus polarisation-level using a minimum orbital basis for single configuration interaction (MOB-SCI) approach. Agreement between the measured and calculated DCSs was qualitatively quite good, although to obtain quantitative accord, the theory would need to incorporate even more channels into the MOB-SCI. The role of multichannel coupling on the computed electronic-state DCSs is also explored in some detail.

9.
J Chem Phys ; 143(9): 094304, 2015 Sep 07.
Artigo em Inglês | MEDLINE | ID: mdl-26342367

RESUMO

We report differential cross sections (DCSs) and integral cross sections (ICSs) for electron-impact vibrational-excitation of pyrimidine, at incident electron energies in the range 15-50 eV. The scattered electron angular range for the DCS measurements was 15°-90°. The measurements at the DCS-level are the first to be reported for vibrational-excitation in pyrimidine via electron impact, while for the ICS we extend the results from the only previous condensed-phase study [P. L. Levesque, M. Michaud, and L. Sanche, J. Chem. Phys. 122, 094701 (2005)], for electron energies ⩽12 eV, to higher energies. Interestingly, the trend in the magnitude of the lower energy condensed-phase ICSs is much smaller when compared to the corresponding gas phase results. As there is no evidence for the existence of any shape-resonances, in the available pyrimidine total cross sections [Baek et al., Phys. Rev. A 88, 032702 (2013); Fuss et al., ibid. 88, 042702 (2013)], between 10 and 20 eV, this mismatch in absolute magnitude between the condensed-phase and gas-phase ICSs might be indicative for collective-behaviour effects in the condensed-phase results.


Assuntos
Pirimidinas/química , Elétrons
10.
J Chem Phys ; 142(12): 124306, 2015 Mar 28.
Artigo em Inglês | MEDLINE | ID: mdl-25833578

RESUMO

We report differential cross sections (DCSs) for electron-impact vibrational-excitation of tetrahydrofuran, at intermediate incident electron energies (15-50 eV) and over the 10°-90° scattered electron angular range. These measurements extend the available DCS data for vibrational excitation for this species, which have previously been obtained at lower incident electron energies (≤20 eV). Where possible, our data are compared to the earlier measurements in the overlapping energy ranges. Here, quite good agreement was generally observed where the measurements overlapped.


Assuntos
Elétrons , Furanos/química , Espalhamento de Radiação , Análise Espectral , Vibração
11.
J Chem Phys ; 142(12): 124307, 2015 Mar 28.
Artigo em Inglês | MEDLINE | ID: mdl-25833579

RESUMO

In this paper, we report newly derived integral cross sections (ICSs) for electron impact vibrational excitation of tetrahydrofuran (THF) at intermediate impact energies. These cross sections extend the currently available data from 20 to 50 eV. Further, they indicate that the previously recommended THF ICS set [Garland et al., Phys. Rev. A 88, 062712 (2013)] underestimated the strength of the electron-impact vibrational excitation processes. Thus, that recommended vibrational cross section set is revised to address those deficiencies. Electron swarm transport properties were calculated with the amended vibrational cross section set, to quantify the role of electron-driven vibrational excitation in describing the macroscopic swarm phenomena. Here, significant differences of up to 17% in the transport coefficients were observed between the calculations performed using the original and revised cross section sets for vibrational excitation.


Assuntos
Elétrons , Furanos/química , Simulação por Computador , Transporte de Elétrons , Gases , Espalhamento de Radiação , Análise Espectral , Vibração
12.
J Chem Phys ; 142(19): 194305, 2015 May 21.
Artigo em Inglês | MEDLINE | ID: mdl-26001459

RESUMO

We report on measurements of integral cross sections (ICSs) for electron impact excitation of a series of composite vibrational modes and electronic-states in phenol, where the energy range of those experiments was 15-250 eV. There are currently no other results against which we can directly compare those measured data. We also report results from our independent atom model with screened additivity rule correction computations, namely, for the inelastic ICS (all discrete electronic states and neutral dissociation) and the total ionisation ICS. In addition, for the relevant dipole-allowed excited electronic states, we also report f-scaled Born-level and energy-corrected and f-scaled Born-level (BEf-scaled) ICS. Where possible, our measured and calculated ICSs are compared against one another with the general level of accord between them being satisfactory to within the measurement uncertainties.


Assuntos
Elétrons , Fenóis/química , Teoria Quântica , Vibração
13.
J Chem Phys ; 143(22): 224304, 2015 Dec 14.
Artigo em Inglês | MEDLINE | ID: mdl-26671372

RESUMO

We report cross sections for electron-impact excitation of vibrational quanta in furfural, at intermediate incident electron energies (20, 30, and 40 eV). The present differential cross sections are measured over the scattered electron angular range 10°-90°, with corresponding integral cross sections subsequently being determined. Furfural is a viable plant-derived alternative to petrochemicals, being produced via low-temperature plasma treatment of biomass. Current yields, however, need to be significantly improved, possibly through modelling, with the present cross sections being an important component of such simulations. To the best of our knowledge, there are no other cross sections for vibrational excitation of furfural available in the literature, so the present data are valuable for this important molecule.

14.
J Chem Phys ; 142(19): 194302, 2015 May 21.
Artigo em Inglês | MEDLINE | ID: mdl-26001456

RESUMO

We report differential cross section results from an experimental investigation into the electron impact excitation of a number of the low-lying composite (unresolved) vibrational modes in phenol (C6H5OH). The measurements were carried out at incident electron energies in the range 15-40 eV and for scattered-electron angles in the range 10-90°. The energy resolution of those measurements was typically ∼80 meV. Calculations, using the GAMESS code, were also undertaken with a B3LYP/aug-cc-pVDZ level model chemistry, in order to enable us to assign vibrational modes to the features observed in our energy loss spectra. To the best of our knowledge, the present cross sections are the first to be reported for vibrational excitation of the C6H5OH molecule by electron impact.

15.
J Chem Phys ; 142(10): 104305, 2015 Mar 14.
Artigo em Inglês | MEDLINE | ID: mdl-25770538

RESUMO

We report results from a joint theoretical and experimental investigation into electron scattering from the important organic species phenol (C6H5OH). Specifically, differential cross sections (DCSs) have been measured and calculated for the electron-impact excitation of the electronic states of C6H5OH. The measurements were carried out at energies in the range 15-40 eV, and for scattered-electron angles between 10° and 90°. The energy resolution of those experiments was typically ∼80 meV. Corresponding Schwinger multichannel method with pseudo-potentials calculations, with and without Born-closure, were also performed for a sub-set of the excited electronic-states that were accessed in the measurements. Those calculations were conducted at the static exchange plus polarisation (SEP)-level using a minimum orbital basis for single configuration interaction (MOBSCI) approach. Agreement between the measured and calculated DCSs was typically fair, although to obtain quantitative accord, the theory would need to incorporate even more channels into the MOBSCI.

16.
J Chem Phys ; 143(14): 144308, 2015 Oct 14.
Artigo em Inglês | MEDLINE | ID: mdl-26472380

RESUMO

The electronic spectroscopy of isolated furfural (2-furaldehyde) in the gas phase has been investigated using high-resolution photoabsorption spectroscopy in the 3.5-10.8 eV energy-range, with absolute cross section measurements derived. Electron energy loss spectra are also measured over a range of kinematical conditions. Those energy loss spectra are used to derive differential cross sections and in turn generalised oscillator strengths. These experiments are supported by ab initio calculations in order to assign the excited states of the neutral molecule. The good agreement between the theoretical results and the measurements allows us to provide the first quantitative assignment of the electronic state spectroscopy of furfural over an extended energy range.


Assuntos
Furaldeído/química , Teoria Quântica , Espectroscopia de Perda de Energia de Elétrons , Elétrons , Espectrofotometria Ultravioleta
17.
J Phys Chem A ; 118(33): 6425-34, 2014 Aug 21.
Artigo em Inglês | MEDLINE | ID: mdl-24742321

RESUMO

The electronic spectroscopy of isolated tetrahydrofurfuryl alcohol (THFA) in the gas phase has been investigated using high-resolution photoabsorption spectroscopy in the 5.0-10.8 eV energy-range, with absolute cross-section measurements derived. The He(I) photoelectron spectrum was also collected to quantify ionization energies in the 9-16 eV spectral region. These experiments are supported by the first high-level ab initio calculations performed on the excited states of the neutral molecule and on the ground and excited state of the positive ion. The good agreement between the theoretical results and the measurements allows us to quantify for the first time the electronic-state spectroscopy of THFA. The present work also considers the question of the lowest energy conformers of the molecule and its population distribution at room temperature.


Assuntos
Furanos/química , Teoria Quântica , Elétrons , Espectrofotometria Ultravioleta
18.
J Chem Phys ; 140(21): 214306, 2014 Jun 07.
Artigo em Inglês | MEDLINE | ID: mdl-24908007

RESUMO

Differential and integral cross section measurements, for incident electron energies in the 20-50 eV range, are reported for excitation of several composite vibrational modes in α-tetrahydrofurfuryl alcohol (THFA). Optimisation and frequency calculations, using GAUSSIAN 09 at the B3LYP/aug-cc-pVDZ level, were also undertaken for the two most abundant conformers of THFA, with results being reported for their respective mode classifications and excitation energies. Those calculations assisted us in the experimental assignments of the composite features observed in our measured energy loss spectra. There are, to the best of our knowledge, no other experimental or theoretical data currently available in the literature against which we can compare the present results.

19.
J Chem Phys ; 141(12): 124307, 2014 Sep 28.
Artigo em Inglês | MEDLINE | ID: mdl-25273437

RESUMO

We have measured (e,2e) triple differential cross sections (TDCS) for the electron-impact ionisation of phenol with coplanar asymmetrical kinematics for an incident electron energy of 250 eV. Experimental measurements of the angular distribution of the slow outgoing electrons at 20 eV are obtained when the incident electron scatters through angles of -5°, -10°, and -15°, respectively. The TDCS data are compared with calculations performed within the molecular 3-body distorted wave model. In this case, a mixed level of agreement, that was dependent on the kinematical condition being probed, was observed between the theoretical and experimental results in the binary peak region. The experimental intensity of the recoil features under all kinematical conditions was relatively small, but was still largely underestimated by the theoretical calculations.


Assuntos
Fenol/química , Elétrons , Modelos Químicos , Estrutura Molecular
20.
J Chem Phys ; 141(2): 024301, 2014 Jul 14.
Artigo em Inglês | MEDLINE | ID: mdl-25028013

RESUMO

We report on measurements of differential cross sections (DCSs) for electron impact excitation of a series of Rydberg electronic-states in α-tetrahydrofurfuryl alcohol (THFA). The energy range of these experiments was 20-50 eV, while the scattered electron was detected in the 10°-90° angular range. There are currently no other experimental data or theoretical computations against which we can directly compare the present measured results. Nonetheless, we are able to compare our THFA DCSs with earlier cross section measurements for Rydberg-state electronic excitation for tetrahydrofuran, a similar cyclic ether, from Do et al. [J. Chem. Phys. 134, 144302 (2011)]. In addition, "rotationally averaged" elastic DCSs, calculated using our independent atom model with screened additivity rule correction approach are also reported. Those latter results give integral cross sections consistent with the optical theorem, and supercede those from the only previous study of Milosavljevic et al. [Eur. Phys. J. D 40, 107 (2006)].


Assuntos
Eletrônica , Furanos/química , Modelos Teóricos , Elétrons , Transferência de Energia
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