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1.
Proteins ; 80(12): 2692-700, 2012 Dec.
Artículo en Inglés | MEDLINE | ID: mdl-22847894

RESUMEN

We present a tensorial elastic network model (TNM) to describe the equilibrium fluctuations of proteins near their native fold structure. The model combines the anisotropic network model (ANM), bond bending elasticity, and backbone twist elasticity, and can predict both the isotropic fluctuations, similar to the Gaussian network model (GNM), and anisotropic fluctuations, similar to the ANM. TNM performs equally well for B-factor predictions as GNM and predicts the anisotropy of B-factors better than ANM. The model also outperforms the ANM in its predictability of the complete anisotropic displacement parameters.


Asunto(s)
Modelos Químicos , Proteínas/química , Proteínas/metabolismo , Anisotropía , Simulación por Computador , Cristalografía por Rayos X , Bases de Datos de Proteínas , Elasticidad , Modelos Moleculares , Distribución Normal , Conformación Proteica , Pliegue de Proteína
2.
Ren Fail ; 27(2): 199-203, 2005.
Artículo en Inglés | MEDLINE | ID: mdl-15807186

RESUMEN

Most patients with chronic renal failure have anemia, which can be corrected by recombinant human erythropoietin (rHuEpo) treatment. Increase in arterial pressure (AP) was reported in some studies and was related to higher systemic vascular resistance induced either by the rise of erythrocyte mass or the change in various endogenous vasopressors, including the direct action of rHuEpo itself. We investigated the effect of rHuEpo treatment on hemodynamic variables, including small and large arterial compliance in 20 patients with chronic renal failure who were not receiving dialysis (CCT 29 +/- 12 mL/min), with Hb levels of 40.4 +/- 0.58 g/dL. They were treated with 2,000 units intravenously followed by 80 to 120 s/c units/kg/body weight, with dosage titration according to Hb level. Noninvasive hemodynamic evaluation was performed before the first rHuEpo treatment, 30 min after the first IV rHuEpo administration and at least 3 months later when target hemoglobin (Hb) and hematocrit (Hct) were reached. No rise in AP occurred after rHuEpo administration either short term or long term. The significant hemodynamic changes were a fall in pulse pressure and a rise in large artery compliance, with no change in small artery compliance after 3 months of rHuEpo treatment when Hb and Hct levels were corrected. These findings show improvement in arterial stiffness when Hb is corrected with rHuEpo treatment.


Asunto(s)
Anemia/tratamiento farmacológico , Eritropoyetina/uso terapéutico , Hemodinámica/efectos de los fármacos , Fallo Renal Crónico/complicaciones , Anciano , Anemia/etiología , Anemia/fisiopatología , Femenino , Humanos , Masculino , Proteínas Recombinantes , Factores de Tiempo , Uremia/tratamiento farmacológico , Uremia/fisiopatología , Resistencia Vascular/efectos de los fármacos
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