Role of 2‐oxo and 2‐thioxo modifications on the proton affinity of histidine and fragmentation reactions of protonated histidine

A combination of electrospray ionisation (ESI), multistage and high‐resolution mass spectrometry experiments was used to compare the gas‐phase chemistry of the amino acids histidine (1), 2‐oxo‐histidine (2), and 2‐thioxo‐histidine (3). Collision‐induced dissociation (CID) of all three different proton‐bound heterodimers of these amino acids led to the relative gas‐phase proton affinity order of: histidine >2‐thioxo‐histidine >2‐oxo‐histidine. Density functional theory (DFT) calculations confirm this order, with the lower proton affinities of the oxidised histidine derivatives arising from their ability to adopt the more stable keto/thioketo tautomeric forms. All protonated amino acids predominately fragment via the combined loss of H₂O and CO to yield a₁ ions. Protonated 2 and 3 also undergo other small molecule losses including NH₃ and the imine HN=CHCO₂H. The observed differences in the fragmentation pathways are rationalised through DFT calculations, which reveal that while modification of histidine via the introduction of the oxygen atom in 2 or the sulfur atom in 3 does not affect the barriers against the loss of H₂O+CO, barriers against the losses of NH₃ and HN=CHCO₂H are lowered relative to protonated histidine. Copyright © 2010 John Wiley & Sons, Ltd.     

Perfect impedance-matched left-handed behavior in combined metamaterial

Matching the impedance of a medium to free space, which is usually not available in natural materials, is an important advance in metamaterials. In this paper, we present a simple mechanism for a perfect impedance-matched left-handed metamaterials, that reveals a nearly zero reflection over operating frequency. This finding is based on the independent manipulation of the electric response without any effect on the magnetic one.     

Absolute exponential stability criteria for a class of nonlinear time-delay systems

This paper is concerned with the problem of absolute exponential stability analysis for a class of continuous-time systems with sector-bounded nonlinearities and interval time-varying delays. Absolute exponential stability criteria, which depend not only on the delay range but also on the decay rate, are derived by using a novel Lyapunov functional. These criteria are expressed in the form of linear matrix inequalities (LMIs) and they can easily be checked. By solving these LMIs, estimates of the exponential decay rate and decay coefficient are obtained. A numerical example is provided to demonstrate the effectiveness of the proposed method.     

A microscopic pedestrian-simulation model and its application to intersecting flows

We develop a microscopic pedestrian-simulation model in which pedestrian positions are updated at discrete time steps. At each time step, each pedestrian probabilistically selects a direction of movement from a predetermined set according to a logit-type function that considers the dynamics of other pedestrians around, and then selects a step size that satisfies a certain distribution. We perform a number of field experiments on real intersecting pedestrian flows with four different angles. We then validate and calibrate the model using sample data on the deviation angles, step velocities, and velocity–density relations obtained from the experiments.     

Triple negative permeability band in plasmon-hybridized cut-wire-pair metamaterials

We expand the picture of plasmon hybridization in metamagnetic structure via numerically studying the electromagnetic coupling in the metallic cut-wire-pair super cells. It is shown that a triple negative permeability band can be achieved by systematically controlling the plasmon hybridization in such the structure. The corresponding transmission properties as well as the electromagnetic responses of the plasmon-hybridized structures were presented by using the finite integration technique simulations. Our results would reveal a promising design to obtain the multiple negative refractions based on the combination of hybridized cut-wire-pairs and continuous wires.     

A multiple regression model for urban traffic noise in Hong Kong

This article describes the roadside traffic noise surveys conducted in heavily built-up urban areas in Hong Kong. Noise measurements were carried out along 18 major roads in 1999. The measurement data included L10, L50, L90, Leq, Lmax, the number of light vehicles, the number of heavy vehicles, the total traffic flow, and the average speed of vehicles. Statistical analysis using the analysis of variance (ANOVA) and Tukey test (p<0.05) reveals that the total traffic flow and the number of heavy vehicles are the most significant factors of urban traffic noise. Multiple regression was used to derive a set of empirical formulas for predicting L10 noise level due to road traffic. The accuracy of these empirical formulas is quantified and compared to that of another widely used prediction model in Hong Kong--the Calculation of Road Traffic Noise. The applicability of the selected multiple regression model is validated by the noise measurements performed in the winter of 2000.     

2,4,6-Tris(4-nitrophenoxy)-1,3,5-triazine: a hexagonal host framework stabilised by the NO2-trimer supramolecular synthon

The title molecule forms a honeycomb network of molecular and nitro-trimer synthons with guest species included in the hexagonal voids.     

Improved contrast to tissue ratio at higher harmonics

The challenge in ultrasound contrast imaging is a better discrimination between the perfused tissue and the contrast bubbles, which is usually expressed by contrast to tissue ratio (CTR). Imaging based on the second harmonic frequency showed a higher CTR than imaging at the fundamental frequency. However, because of nonlinear propagation of ultrasound waves, harmonic frequencies are generated. These harmonic frequencies will be linearly reflected by the tissue and therefore limit the CTR at the second harmonic frequency. In order to reduce the scattering of tissue at harmonic frequencies and by that increase the CTR, nonlinear distortion has to be reduced. We demonstrate in this study that the CTR increases with the harmonic number. The increase is substantial when transmitting at lower frequencies. To take advantage of the higher harmonics (third, fourth, fifth and the ultraharmonics and termed here super harmonics), we have developed a new phased array transducer with a wide frequency band. In-vitro measurements using the new probe show an increase of 40 dB of the CTR for super harmonic components over the conventional second harmonic system. The increase in CTR is in agreement with the calculations using existing models for the response of encapsulated bubbles and known theory of nonlinear propagation.