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1.
Vet Dermatol ; 35(3): 337-345, 2024 Jun.
Article in English | MEDLINE | ID: mdl-38379189

ABSTRACT

BACKGROUND: Otitis is characterised by inflammation of one or more of the structures of the ear. At present, to confirm or exclude otitis media (OM), it is most often necessary to perform a computed tomography (CT) scan or magnetic resonance imaging. Inflammation is an immune defence response found in many conditions that can be detected and tracked by measuring biological markers of inflammation as the Canine C-reactive protein (CRP). OBJECTIVES: The objective of this study was to determine whether CRP measurement is useful as an adjunctive diagnostic tool in dogs with otitis and whether elevated concentrations correlated with disease severity/presence of OM. ANIMALS: Twenty-four client-owned dogs were recruited over 1 year. MATERIALS AND METHODS: The dogs were divided into three groups: chronic or recurrent otitis externa (CO), otitis media (OM) and H (healthy). The dogs with otitis underwent a CT scan of the head, measurement of the plasma CRP concentration and evaluation of a 0-3 Otitis Index Score 3 (OTIS3 score). RESULTS: No dog (0%) in group H had an increased CRP value, compared to 20% in the CO group (one of five dogs) and 23% in the OM group (3 of 13 dogs). Plasma CRP concentrations show a statistically significant positive relationship with the OTIS3 score (p = 0.04). CONCLUSION AND CLINICAL RELEVANCE: Plasma CRP concentration is not reliable as a discriminatory tool in cases of otitis, although there is a trend for elevation in cases with more severe disease. However, a larger study may provide a statistically more reliable correlation between the severity of OM and CRP concentrations.


Subject(s)
C-Reactive Protein , Dog Diseases , Otitis Externa , Otitis Media , Animals , Dogs , C-Reactive Protein/analysis , C-Reactive Protein/metabolism , Otitis Media/veterinary , Otitis Media/blood , Dog Diseases/blood , Dog Diseases/diagnosis , Otitis Externa/veterinary , Otitis Externa/blood , Female , Male , Chronic Disease/veterinary , Biomarkers/blood , Tomography, X-Ray Computed/veterinary
2.
Heliyon ; 8(12): e12132, 2022 Dec.
Article in English | MEDLINE | ID: mdl-36506380
3.
Oxf Open Immunol ; 3(1): iqac009, 2022.
Article in English | MEDLINE | ID: mdl-36846563

ABSTRACT

Wegener's granulomatosis is an autoimmune disease where autoantibodies target human autoantigen PR3, a serine protease locates on the neutrophil membrane. This disease affects blood small vessels and could be deadly. The origin of these autoantibodies is unknown, but infections have been implicated with autoimmune disease. In this study, we explored potential molecular mimicry between human PR3 and homologous pathogens through in silico analysis. Thirteen serine proteases from human pathogens (Klebsiella pneumoniae, Acinetobacter baumannii, Salmonella sp., Streptococcus suis, Vibrio parahaemolyticus, Bacteroides fragilis, Enterobacter ludwigii, Vibrio alginolyticus, Staphylococcus haemolyticus, Enterobacter cloacae, Escherichia coli and Pseudomonas aeruginosa) shared structural homology and amino acid sequence identity with human PR3. Epitope prediction found an only conserved epitope IVGG, located between residues 59-74. However, multiple alignments showed conserved regions that could be involved in cross-reactivity between human and pathogens serine proteases (90-98, 101-108, 162-169, 267 and 262 residues positions). In conclusion, this is the first report providing in silico evidence about the existence of molecular mimicry between human and pathogens serine proteases, that could explain the origins of autoantibodies found in patients suffering from Wegener's granulomatosis.

5.
J Chem Phys ; 134(13): 134102, 2011 Apr 07.
Article in English | MEDLINE | ID: mdl-21476738

ABSTRACT

Different computational methods are employed to calculate excitation energies of the carbon atom. Explicitly correlated wave functions have been obtained in a Variational Monte Carlo calculation. Fixed node Diffusion Monte Carlo calculations for the lowest energy excited states of a given symmetry are reported. A systematic and quantitative analysis of the performance of the different schemes in the calculation of the excitation energy of up to 27 excited states of the carbon atom is carried out. The quality of the different methods have been studied in terms of the deviation with respect to the experimental excitation energies. A good agreement with the experimental values has been reached.

6.
J Chem Phys ; 133(6): 064102, 2010 Aug 14.
Article in English | MEDLINE | ID: mdl-20707556

ABSTRACT

Nonrelativistic frozen nucleus all-electron Quantum Monte Carlo ground state energies of positive and negative ions Li(+) to Ar(+) and Li(-) to Cl(-), respectively, are reported. Explicitly correlated wave functions with a single configuration model function times a Jastrow factor are employed for all of the systems studied. The accuracy obtained for the ions in the third period is similar to that reached for the ions in the second one. For those ions with a stronger multiconfiguration nature a restricted multiconfiguration expansion has been employed. The ground state energy here obtained for the charged species shows a similar quality to that reached for neutral atoms. Starting from those results, ionization potentials and electron affinities are calculated.

7.
J Phys Chem A ; 114(4): 1953-6, 2010 Feb 04.
Article in English | MEDLINE | ID: mdl-20055398

ABSTRACT

The ground state and the LS terms coming from the ground-state configuration, [Ar]-3d(6)4s(2), of the iron atom are studied by carrying out an all electron Variational Monte Carlo calculation. Explicitly correlated trial functions including near degeneracy effects are used. The effect of electronic correlations and the importance of near degeneracy effects are systematically analyzed for the states here considered and compared with the experimental values. Correlations are important to reproduce, even qualitatively, the low-lying spectrum of this atom. A significant quantitative improvement when comparing with the experimental values is achieved when near degeneracy is considered along with dynamic correlations in the variational trial wave function. Finally, the effect of relativity on the results here reported is discussed.

8.
J Chem Phys ; 131(4): 044115, 2009 Jul 28.
Article in English | MEDLINE | ID: mdl-19655845

ABSTRACT

All-electron quantum Monte Carlo energies are reported for the ground state of the atoms Li to Ar. The present work is mainly focused on the atoms Na to Ar as well as in those that have a stronger multiconfiguration nature, i.e., Be, B, and C and Mg, Al, and Si. Explicitly correlated wave functions with a single configuration model function times a Jastrow factor are employed for all of the atoms studied. The accuracy obtained for the atoms Na to Ar is similar to that reached for the atoms Li to Ne. In addition, a restricted multiconfiguration expansion has been employed for the atoms Be, B, and C and Mg, Al, and Si obtaining accurate results. Near degeneracy and the effect of other configurations are systematically analyzed for these systems, at both variational and diffusion Monte Carlo levels.

9.
J Phys Chem A ; 112(10): 2074-6, 2008 Mar 13.
Article in English | MEDLINE | ID: mdl-18220374

ABSTRACT

The domain Green's function Monte Carlo method has been used to calculate the ground-state energy of the atoms Sc through Zn. The fixed node approximation with single-configuration explicitly correlated wave functions is used. A comparison with variational Monte Carlo energies is carried out. The quality of the ground-state energies reported here is similar to that achieved for few-electron atoms using similar techniques.

10.
J Chem Phys ; 124(15): 154101, 2006 Apr 21.
Article in English | MEDLINE | ID: mdl-16674212

ABSTRACT

We study the states arising from the [Ar]4s(2)3d6 and [Ar]4s(1)3d7 configurations of iron atom with explicitly correlated wave functions. The variational wave function is the product of the Jastrow correlation factor times a model function obtained within the parametrized optimized effective potential framework. A systematic analysis of the dependence of both the effective potential and the correlation factor on the configuration and on the term is carried out. The ground state of both, the cation, Fe+, and anion, Fe-, are calculated with correlated wave functions and the ionization potential and the electron affinity are obtained.

11.
J Chem Phys ; 124(4): 044319, 2006 Jan 28.
Article in English | MEDLINE | ID: mdl-16460174

ABSTRACT

The (3)P ground state and both the (1)D and (1)S excited states arising from the low-lying 1s(2)2s(2)2p(2) configuration of the carbon isoelectronic series are studied starting from explicitly correlated multiconfigurational wave functions. One- and two-body densities in position space have been calculated and different one- and two-body expectation values have been obtained. The effects of electronic correlations have been systematically studied. All the calculations have been done by means of variational Monte Carlo.

12.
J Chem Phys ; 123(3): 34302, 2005 Jul 15.
Article in English | MEDLINE | ID: mdl-16080732

ABSTRACT

For some members of the boron isoelectronic series and starting from explicitly correlated wave functions, six low-lying excited states have been studied. Three of them arise from the 1s(2)2p(3) configuration, and the other three from the 1s(2)2s(2)3l, l = s,p,d, configurations. This work follows a previous one on both the 1s(2)2s(2)2p-(2)P ground state and the four excited states coming from the 1s(2)2s2p(2) configuration. Energies, one- and two-body densities in position space and some other two-body properties in position and momentum spaces have been obtained. A systematic analysis of the energetic ordering of the states as a function of the total orbital angular momentum and spin is performed in terms of the electron-nucleus and electron-electron potential energies and the role of the angular correlation is discussed. All calculations have been carried out by using the Monte Carlo algorithm.

13.
J Chem Phys ; 122(15): 154307, 2005 Apr 15.
Article in English | MEDLINE | ID: mdl-15945635

ABSTRACT

The ground state and some low-lying excited states arising from the 1s2 2s2p2 configuration of the boron isoelectronic series are studied starting from explicitly correlated multideterminant wave functions. One- and two-body densities in position space have been calculated and different expectation values such as , , , , , and , where r, r12, and R stand for the electron-nucleus, interelectronic, and two electron center of mass coordinates, respectively, have been obtained. The energetic ordering of the excited states and the fulfillment of the Hund's rules is analyzed systematically along the isoelectronic series in terms of the electron-electron and electron-nucleus potential energies. The effects of electronic correlations have been systematically studied by comparing the correlated results with the corresponding noncorrelated ones. All the calculations have been done by using the variational Monte Carlo method.

14.
Int J Tuberc Lung Dis ; 8(1): 98-105, 2004 Jan.
Article in English | MEDLINE | ID: mdl-14974752

ABSTRACT

SETTING: The immunological mechanisms that lead to the control of Mycobacterium tuberculosis infection are not well known. OBJECTIVE: To study the role of lymphocyte subsets and co-stimulatory molecules in M. tuberculosis infection. DESIGN: In 35 patients with pulmonary tuberculosis (PTB) and their contacts, 29 persons with tuberculin skin test conversion (TSTC) and 20 healthy individuals with negative tuberculin skin test (NTST), we studied T-lymphocyte subsets (CD3, CD4, CD8, alphabetaTCR and gammadeltaTCR), B-cells, monocytes and co-stimulatory molecules CD28 and CD86 in peripheral blood. The results were analysed at univariate and multivariate level through discriminant analysis. RESULTS: At univariate level, compared with TSTC and NTST, PTB patients presented a decrease in CD4+ T-cells (P = 0.002), and B-cells (P = 0.02 and 0.001, respectively). With regard to NTST subjects, PTB patients also showed a decrease in the percentage of CD86+ monocytes (P = 0.02) and an increase in the percentage of CD86+ B-lymphocytes (P = 0.02). At multivariate level, CD4+ T-lymphocytes showed statistical differences between PTB and TSTC subjects (P = 0.001). B-lymphocytes were discriminant between PTB and NTST (P < 0.001) and between TSTC and NTST individuals (P = 0.01). CONCLUSION: The number of total CD4+ T-cells is the best discriminant parameter for distinguishing between disease and infection, whereas the B-cell count is the best between healthy and infected individuals.


Subject(s)
B-Lymphocytes/immunology , Bronchoalveolar Lavage Fluid/immunology , Lymphocyte Subsets/immunology , Mycobacterium tuberculosis/immunology , Tuberculosis/immunology , Adult , Antigens, CD/immunology , CD4 Lymphocyte Count , CD4-Positive T-Lymphocytes/immunology , Case-Control Studies , Cohort Studies , Female , Humans , Immunity, Cellular/physiology , Linear Models , Middle Aged , Multivariate Analysis , Probability , Reference Values , Sensitivity and Specificity , Spain/epidemiology , Tuberculin Test , Tuberculosis/epidemiology
16.
Phytomedicine ; 9(2): 85-92, 2002 Mar.
Article in English | MEDLINE | ID: mdl-11995954

ABSTRACT

A multicentric, open, prospective, observational and no-randomized clinical trial was carried out in Spain with 190 postmenopausal women receiving a soy preparation rich in isoflavones (PHYTO SOYA, capsules containing 17.5 mg isoflavones). The main object of the present study was to investigate its efficacy in alleviating the symptomatology derived from the lack of estrogen, mainly hot flushes, but also other symptoms such as sleep disorder, anxiety, depression, vaginal dryness, loss of libido and bone pain. Each patient received 35 mg isoflavones per day in two doses. During the four months' treatment, a statistically significant decrease in the number of hot flushes with PHYTO SOYA was experienced by 80.82% women; only 5,48% patients did not improve with the treatment. The average reduction was 47.8%, which is equivalent to 4 hot flushes. All the other studied parameters also showed a statistically significant decrease. No severe side-effects were reported and tolerance was excellent. Treatment with PHYTO SOYA resulted in a significant improvement of the symptomatology that accompanies the lack of estrogen during menopause.


Subject(s)
Climacteric/drug effects , Estrogens, Non-Steroidal/therapeutic use , Glycine max , Hot Flashes/drug therapy , Phytotherapy , Anxiety/drug therapy , Blood Pressure/drug effects , Chromatography, High Pressure Liquid , Depression/drug therapy , Estrogens, Non-Steroidal/adverse effects , Estrogens, Non-Steroidal/pharmacology , Female , Humans , Isoflavones/chemistry , Isoflavones/therapeutic use , Menopause/drug effects , Metrorrhagia/chemically induced , Middle Aged , Molecular Structure , Pain/chemically induced , Phytoestrogens , Plant Extracts/adverse effects , Plant Extracts/pharmacology , Plant Extracts/therapeutic use , Plant Preparations , Prospective Studies , Sleep Wake Disorders/drug therapy , Spectrum Analysis , Statistics as Topic , Surveys and Questionnaires , Treatment Outcome
17.
Alergol. inmunol. clín. (Ed. impr.) ; 16(6): 337-346, dic. 2001. tab
Article in Es | IBECS | ID: ibc-12926

ABSTRACT

Antecedentes y objetivos: Anisakis simplex causa reacciones alérgicas tras la ingesta de pescado parasitado. Nuestros objetivos son conocer la prevalencia de sensibilización y de alergia a Anisakis simplex en España. Material y métodos: Estudiamos dos poblaciones: Grupo U: pacientes con un episodio de urticaria/angioedema; Grupo NU: sujetos sin historia de reacciones alérgicas. 434 sujetos en cada grupo, pareados por edad y sexo, se estudiaron mediante cuestionario, prick-tests con extractos de Anisakis simplex y pescados, y determinaciones de IgE total y específica. La muestra fue dividida en tres áreas según su consumo de pescado. Criterio de sensibilización: prick-test positivo o anticuerpos IgE específicos a Anisakis simplex; Criterio de alergia: Urticaria/angioedema tras la ingesta de pescado, sensibilización a Anisakis simplex y exclusión de la sensibilización a pescado. Resultados: La prevalencia de sensibilización fue de 38,1 por ciento en el grupo U y 13,1 por ciento en el grupo NU. El riesgo de sensibilización aumenta con la edad, la ingesta de pescado no cocinado y los títulos elevados de IgE total. El 19,2 por ciento de los pacientes del grupo U se diagnosticaron de alergia a Anisakis simplex. La IgE específica a Anisakis simplex es la única variable asociada independientemente a alergia al parásito. La prevalencia de sensibilización y alergia a Anisakis simplex es mayor en el área centro (consumo de pescado intermedio) donde la ingesta de pescado no cocinado es más frecuente. Conclusiones: Se detecta una elevada frecuencia de sensibilización y alergia a Anisakis simplex en España. La elevada frecuencia de anticuerpos IgE específicos a Anisakis simplex en sujetos con y sin reacciones alérgicas supone un importante factor de confusión para el diagnóstico. Las variables asociadas a la sensibilización sugieren que la parasitación es frecuente (AU)


Subject(s)
Female , Male , Humans , Anisakis , Hypersensitivity/parasitology , Spain , Prevalence , Multicenter Studies as Topic , Hypersensitivity/diagnosis , Urticaria/diagnosis , Fishes/parasitology
19.
J Neuroimmunol ; 113(1): 146-52, 2001 Feb 01.
Article in English | MEDLINE | ID: mdl-11137586

ABSTRACT

To assess the involvement of the immune system in Parkinson's disease we studied the phenotype of circulating lymphocytes in 30 untreated and 34 treated patients. We found a numeric decrease in helper T cells (higher in CD4(+)CD45RA(+) than in CD4(+)CD29(+)) and B cells, and a rise in activated, CD4(+)CD25(+) lymphocytes that was correlated with lymphocyte depletion. All these alterations were independent of levodopa treatment. In addition, we performed striatal dopamine depletion in rats with either MPP(+) or 6-OHDA, showing that MPP(+) but not 6-OHDA can increase CD4(+)CD25(+) lymphocytes. Thus, mechanisms other than dopamine deficit may explain the immune activation in Parkinson's disease.


Subject(s)
CD4-Positive T-Lymphocytes/immunology , MPTP Poisoning/immunology , Parkinson Disease/immunology , Aged , Animals , CD4-Positive T-Lymphocytes/chemistry , CD4-Positive T-Lymphocytes/cytology , Disease Models, Animal , Humans , Leukocyte Common Antigens/analysis , Leukocyte Common Antigens/immunology , Lymphocyte Activation/immunology , Male , Middle Aged , Oxidopamine , Rats , Rats, Sprague-Dawley , Receptors, Interleukin-2/blood , Receptors, Interleukin-2/immunology , Solubility , Sympatholytics
20.
Alergol. inmunol. clín. (Ed. impr.) ; 15(5): 310-316, oct. 2000. ilus
Article in Es | IBECS | ID: ibc-3461

ABSTRACT

Fundamento: Los eosinófilos, células que participan en los mecanismos inflamatorios que suceden en el asma, expresan en su superficie receptores para la IgE. El receptor de baja afinidad para la IgE (Fce RII/CD23) se ha implicado en la regulación de la síntesis de IgE, por lo que es posible que los pacientes asmáticos alérgicos presenten una mayor expresión de CD23 en eosinófilos. Métodos: En 10 pacientes asmáticos (cinco sensibilizados a Dermatophagoides pteronyssinus (PAA) y cinco no alérgicos (PANA), se estudió mediante citometría de flujo la expresión de CD23 en los eosinófilos de sangre periférica y en cultivos de eosinófilos incubados, respectivamente, con GM-CSF, IL-4, IFN-g o medio condicionado (MC) obtenido de cultivos de células mononucleadas estimuladas con fitohemaglutinina. En dicho medio se cuantificaron las concentraciones de IL-3, IL-4, GM-CSF y CD23 soluble (CD23s). Resultados: La expresión de CD23 en los eosinófilos se detectó en el 60 por ciento de los PAA y en el 40 por ciento de los PANA. En ambos grupos, los cultivos de eosinófilos incubados con GM-CSF, IL-4 o IFN-g mostraron un menor porcentaje de eosinófilos que expresaban CD23 ( por cientoEosCD23+) que los cultivos sin estas citocinas, mientras que la adición de MC aumentaba dicho porcentaje. En los cultivos con MC de los PAA se observó una correlación entre el por cientoEosCD23+ y las concentraciones de CD23s del MC. Conclusiones: La expresión de CD23 en eosinófilos es similar en ambos grupos de pacientes asmáticos, aunque en los PAA dicha expresión podría estar en parte modulada por el CD23s procedente de los linfocitos. (AU)


Subject(s)
Female , Male , Humans , Asthma/immunology , Eosinophils/immunology , Case-Control Studies , Cytokines/blood , Cell Culture Techniques/methods
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