Pressure-dependent 13C chemical shifts in proteins: Origins and applications

Pressure-dependent (13)C chemical shifts have been measured for aliphatic carbons in barnase and Protein G. Up to 200 MPa (2 kbar), most shift changes are linear, demonstrating pressure-independent compressibilities. CH(3), CH(2) and CH carbon shifts change on average by +0.23, -0.09 and -0.18 ppm, respectively, due to a combination of bond shortening and changes in bond angles, the latter matching one explanation for the gamma-gauche effect. In addition, there is a residue-specific component, arising from both local compression and conformational change. To assess the relative magnitudes of these effects, residue-specific shift changes for protein G were converted into structural restraints and used to calculate the change in structure with pressure, using a genetic algorithm to convert shift changes into dihedral angle restraints. The results demonstrate that residual (13)C alpha shifts are dominated by dihedral angle changes and can be used to calculate structural change, whereas (13)C beta shifts retain significant dependence on local compression, making them less useful as structural restraints

Preparation of Emulsifier-Free Polystyrene by Conventional Emulsion Polymerization with a Hydrolysable Emulsifier

An alkali-hydrolysable surfactant, (1-tetradecyloxycarbonylmethyl)trimethylammonium chloride, was used as an emulsifier for emulsion polymerization of styrene in water. The polymerization yielded a high molecular-weight polymer almost quantitatively. Addition of a small amount of NaOH to the resulting latex solution precipitated the polymer immediately. Analysis of the centrifuged solid indicated almost perfection of both recovery of the polymer and removal of surface-active species from it. Minimization of ionic species in the polymer solid was confirmed by a high contact angle of the polymer film with water.Ministry of Education, Science, Sports and Culture of Japan.ArticleJOURNAL OF APPLIED POLYMER SCIENCE Vol:108 No.:1 Page:358-361journal articl

Stretched exponential behavior in remanent lattice striction of a (La,Pr)1.2_{1.2}Sr1.8_{1.8}Mn2_{2}O7_{7} bilayer manganite single crystal

We have investigated the time dependence of remanent magnetostriction in a (La,Pr)$_{1.2}$Sr$_{1.8}$Mn$_{2}$O$_{7}$ single crystal, in order to examine the slow dynamics of lattice distortion in bilayered manganites. A competition between double exchange and Jahn-Teller type orbital-lattice interactions results in the observed lattice profile following a stretched exponential function. This finding suggests that spatial growth of the local lattice distortions coupled with e$_{g}$-electron orbital strongly correlates with the appearance of the field-induced CMR effect.Comment: 3 figure

Resistive relaxation in field-induced insulator-metal transition of a (La0.4_{0.4}Pr0.6_{0.6})1.2_{1.2}Sr1.8_{1.8}Mn2_{2}O7_{7} bilayer manganite single crystal

We have investigated the resistive relaxation of a (La$_{0.4}$Pr$_{0.6}$)$_{1.2}$Sr$_{1.8}$Mn$_{2}$O$_{7}$ single crystal, in order to examine the slow dynamics of the field-induced insulator to metal transition of bilayered manganites. The temporal profiles observed in remanent resistance follow a stretched exponential function accompanied by a slow relaxation similar to that obtained in magnetization and magnetostriction data. We demonstrate that the remanent relaxation in magnetotransport has a close relationship with magnetic relaxation that can be understood in the framework of an effective medium approximation by assuming that the first order parameter is proportional to the second order one.Comment: 6 pages,5 figure

On irreducibility of tensor products of evaluation modules for the quantum affine algebra

Every irreducible finite-dimensional representation of the quantized enveloping algebra U_q(gl_n) can be extended to the corresponding quantum affine algebra via the evaluation homomorphism. We give in explicit form the necessary and sufficient conditions for irreducibility of tensor products of such evaluation modules.Comment: 22 pages. Some references are adde

Real-world clinical utility and impact on clinical decision-making of coronary computed tomography angiography-derived fractional flow reserve: lessons from the ADVANCE Registry.

Aims:Non-invasive assessment of stable chest pain patients is a critical determinant of resource utilization and clinical outcomes. Increasingly coronary computed tomography angiography (CCTA) with selective CCTA-derived fractional flow reserve (FFRCT) is being used. The ADVANCE Registry, is a large prospective examination of using a CCTA and FFRCT diagnostic pathway in real-world settings, with the aim of determining the impact of this pathway on decision-making, downstream invasive coronary angiography (ICA), revascularization, and major adverse cardiovascular events (MACE). Methods and results:A total of 5083 patients with symptoms concerning for coronary artery disease (CAD) and atherosclerosis on CCTA were enrolled at 38 international sites from 15 July 2015 to 20 October 2017. Demographics, symptom status, CCTA and FFRCT findings, treatment plans, and 90 days outcomes were recorded. The primary endpoint of reclassification between core lab CCTA alone and CCTA plus FFRCT-based management plans occurred in 66.9% [confidence interval (CI): 64.8-67.6] of patients. Non-obstructive coronary disease was significantly lower in ICA patients with FFRCT ≤0.80 (14.4%) compared to patients with FFRCT \u3e0.80 (43.8%, odds ratio 0.19, CI: 0.15-0.25, P \u3c 0.001). In total, 72.3% of subjects undergoing ICA with FFRCT ≤0.80 were revascularized. No death/myocardial infarction (MI) occurred within 90 days in patients with FFRCT \u3e0.80 (n = 1529), whereas 19 (0.6%) MACE [hazard ratio (HR) 19.75, CI: 1.19-326, P = 0.0008] and 14 (0.3%) death/MI (HR 14.68, CI 0.88-246, P = 0.039) occurred in subjects with an FFRCT ≤0.80. Conclusions:In a large international multicentre population, FFRCT modified treatment recommendation in two-thirds of subjects as compared to CCTA alone, was associated with less negative ICA, predicted revascularization, and identified subjects at low risk of adverse events through 90 days

Strain-Rate Effects on Microstructural Deformation in Irradiated 316 SS

A series of studies have been performed to investigate the post-irradiation deformation and failure behavior of 12% cold-worked 316 stainless steel following irradiation to variety of doses and temperatures in the outer rows of the experimental breeder reactor II (EBR-II). In the current phase of these studies, three sets of samples with different radiation induced microstructures have been characterized with transmission electron microscopy (TEM) following tensile testing to failure at a ‘fast’ strain-rate (1 x 10-3 s-1) and a ‘slow’ strain-rate (1 x 10-7 s-1). The samples were irradiated to doses between 9 and 41 dpa at temperatures between 383 and 443 degrees C. Tensile tests were conducted at a temperature of 430 degrees C and only regions outside of the necked region were examined. Over the parameters tested, strain-rate had a negligible effect on the deformation microstructure. In addition, there was no clear evidence of localized deformation behavior and the deformation appeared relatively homogeneous, characterized by unfaulting and incorporation of faulted dislocation loops into the general dislocation network structure. The influence of the defect microstructures and strain-rate on deformation behavior is discussed

A prospective multicenter validation study for a novel angiography-derived physiological assessment software:Rationale and design of the radiographic imaging validation and evaluation for Angio-iFR (ReVEAL iFR) study

Background Angiography-derived physiological assessment of coronary lesions has emerged as an alternative to wire based assessment aiming at less-invasiveness and shorter procedural time as well as cost effectiveness in physiology-guided decision making. However, current available image-derived physiology software have limitations including the requirement of multiple projections and are time consuming. Methods/Design The ReVEAL iFR (Radiographic imaging Validation and EvALuation for Angio-iFR) trial is a multicenter, multicontinental, validation study which aims to validate the diagnostic accuracy of the Angio-iFR medical software device (Philips, San Diego, US) in patients undergoing angiography for Chronic Coronary Syndrome (CCS). The Angio-iFR will enable operators to predict both the iFR and FFR value within a few seconds from a single projection of cine angiography by using a lumped parameter fluid dynamics model. Approximately 440 patients with at least one de-novo 40% to 90% stenosis by visual angiographic assessment will be enrolled in the study. The primary endpoint is the sensitivity and specificity of the iFR and FFR for a given lesion compared to the corresponding invasive measures. The enrollment started in August 2019, and was completed in March 2021. Summary The Angio-iFR system has the potential of simplifying physiological evaluation of coronary stenosis compared with available systems, providing estimates of both FFR and iFR. The ReVEAL iFR study will investigate the predictive performance of the novel Angio-iFR software in CCS patients. Ultimately, based on its unique characteristics, the Angio-iFR system may contribute to improve adoption of functional coronary assessment and the workflow in the catheter laboratory