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Ferrochelatase is the terminal enzyme in haem biosynthesis, i.e. the enzyme that inserts a ferrous ion into the porphyrin ring. Suggested reaction mechanisms for this enzyme involve a distortion of the porphyrin ring when it is bound to the enzyme. We have examined the energetics of such distortions using various theoretical calculations. With the density functional B3LYP method we calculate how m
Abstract: Studies reported in this paper indicate the Presence of a relation between NOAA/AVHRR data and crop biomass in Sweden. Conclusions so far, however, are that NOAA/AVHRR at the present time can not be successfully applied for operational crop biomass estimation in Sweden. Investigations are now in progress aiming at the practical use of this remotely sensed data for the determination of bi
2,4,6-Trinitrotoluene (TNT) is the major explosive in ammunition dumped into lakes and the sea after World War II. To identify useful biomarkers of TNT-exposure for forthcoming fish monitoring studies at ammunition dumping sites, rainbow trout (Oncorhynchus mykiss) were intraperitoneal (i.p.) injected with TNT in peanut oil at doses of 0, 100, 200 or 400 mg TNT/kg body weight and sampled 72 h late
Different ways of approximating the exchange-repulsion energy with a classical potential function have been investigated by fitting various expressions to the exact exchange-repulsion energy for a large set of molecular dimers. The expressions involve either the orbital overlap or the electron-density overlap. For comparison, the parameter-free exchange-repulsion model of the effective fragment po
Microchip immobilized enzyme reactors (mu IMERs) with immobilized endoglucanases were applied for the hydrolysis of methyl cellulose (MC). MCs of various molecular weights were hydrolyzed using two mu IMERs containing immobilized celloendoglucanase Cel 5A from Bacillus agaradhaerens (BaCel 5A) connected in series. Hydrolysis by the mu IMER could be confirmed from the average molar masses and molar
We demonstrate metal organic vapour phase epitaxy growth of GaP/GaAs1-xPx/GaP double heterostructure nanowires on GaP(111)B, and report bright photoluminescence at room temperature. By using different PH3 to AsH3 flow ratios during growth of the GaAs1-xPx segment, we are able to control the composition of the segment, making it feasible to tune the wavelength of the emitted light. A photoluminesce
We consider a Fermi pencil-beam model in two-space dimensions (x,y), where x is aligned with the beam’s penetration direction and y together with the scaled angular variable z correspond to a, bounded symmetric, transversal cross-section. The model corresponds to a forward–backward degenerate, convection dominated, convection–diffusion problem. For this problem we study some fully discrete numeric
Non-linear waves have been a research topic for a long time, but have not yet entered common ocean engineering practice. In this article the problem of calculating the probability density function (pdf) for non-linear waves is investigated. The 'saddle point approximation' is applied to a second-order wave model to estimate the pdf. The performance of the approximation is compared with the perform
In this paper we describe how the contention-based medium access mechanism of 802.11e, EDCA, can be enhanced in order to allow stations to reserve medium access for their real-time applications with QoS requirements. We present our proposed scheme, which is called EDCA with resource reservation (EDCA/RR), and describe how it can be extended in order to be used in wireless multi-hop networks. EDCA/
We show that operator-valued Bergman inner functions have the so-called expansive multiplier property generalizing a well-known result of Hedenmalm in the scalar case. This analysis leads to norm bounds for input output maps for a related class of discrete time linear systems. The proof uses properties of the biharmonic Green function. (C) 2009 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim
in this paper, we introduce two new methods for solving binary quadratic problems. While spectral relaxation methods have been the workhorse subroutine for a wide variety of computer vision problems-segmentation, clustering, subgraph matching to name a few-it has recently been challenged by semidefinite programming (SDP) relaxations. In fact, it can be shown that SDP relaxations produce better low
The authors present the fabrication and characterization of an integrated optical readout scheme based on single-mode waveguides for cantilever-based sensors. The cantilever bending is read out by monitoring changes in the optical intensity of light transmitted through the cantilever that also acts as a waveguide. The complete system is fabricated in the photosensitive polymer SU-8. They show theo
All the support tools that developers are used to must be in place, if the use of model-centric development in companies hits to take off. Industry deals with big models and many people working on the same model. Collaboration in a team inevitably leads to parallel work creating different versions that eventually will have to be merged together. However, our experience is that at present the suppo
A maximum likelihood methodology for the parameters of models with an intractable likelihood is introduced. We produce a likelihood-free version of the stochastic approximation expectation-maximization (SAEM) algorithm to maximize the likelihood function of model parameters. While SAEM is best suited for models having a tractable "complete likelihood" function, its application to moderately comple
