Multivalency as a Chemical Organization and Action Principle

Multivalent interactions can be applied universally for a targeted strengthening of an interaction between different interfaces or molecules. The binding partners form cooperative, multiple receptor–ligand interactions that are based on individually weak, noncovalent bonds and are thus generally reversible. Hence, multi‐ and polyvalent interactions play a decisive role in biological systems for recognition, adhesion, and signal processes. The scientific and practical realization of this principle will be demonstrated by the development of simple artificial and theoretical models, from natural systems to functional, application‐oriented systems. In a systematic review of scaffold architectures, the underlying effects and control options will be demonstrated, and suggestions will be given for designing effective multivalent binding systems, as well as for polyvalent therapeutics.     

Multi-scale magnetic resonance measurements and validation of Discrete Element Model simulations

This short review describes the capabilities of magnetic resonance (MR) to image opaque single- and two-phase granular systems, such as rotating cylinders and gas-fluidized beds operated in different fluidization regimes. The unique capability of MR to not only image the solids’ distribution (voidage) but also the velocity of the particulate phase is clearly shown. It is demonstrated that MR can provide measurements over different length and time scales. With the MR equipment used for the studies summarized here, temporal and spatial scales range from sub-millisecond to hours and from a few hundred micrometres to a few centimetres, respectively. Besides providing crucial data required for an improved understanding of the underlying physics of granular flows, multi-scale MR measurements were also used to validate numerical simulations of granular systems. It is shown that predictions of time-averaged properties, such as voidage and velocity of the particulate phase, made using the Discrete Element Model agree very well with MR measurements.     

Dynamic flow in a realistic model of the upper human lung airways

The objective of the study is an analysis of lung ventilation during breathing under rest conditions and for high frequency ventilation (HFV). The measurements include investigations of the flow using an endotracheal tube. A transparent model of the upper human lung airways down to the 6th generation was generated, and the oscillatory flow through the branching network was studied by DPIV. The method of refractive index matching of the fluid (water/glycerin) and the model (silicone) allows an unobstructed view into the internal flow network. The mass flow rate and the frequency were adapted to the characteristic flow parameters, the Reynolds- and the Womersley-number. The comparison of the results for normal breathing and HFV shows that a mass exchange occurs for higher frequencies known as Pendelluft, which could not be seen during normal breathing. This mass exchange between the daughter tubes is a consequence of the asymmetric impedance in the successive daughter branches. The lung topology determines the local pressure loss in the model and therefore the local mass flow direction of the Pendelluft. At higher frequencies we observed an increase in exchange between the daughter branches. The transformation of the velocity profiles between inspiration and expiration suggests a net mass flow which is created into the model along the centerline and the inner walls of the bifurcations. This flow is compensated with a net mass outflow to the trachea along the outer walls of the branches.     

Circle approximation using LN Bézier curves of even degree and its application

We present an approximation method of circular arcs using linear-normal (LN) Bézier curves of even degree, four and higher. Our method achieves G^m$G^m$ continuity for endpoint interpolation of a circular arc by a LN Bézier curve of degree 2m  , for m=2,3$m=2,3$. We also present the exact Hausdorff distance between the circular arc and the approximating LN Bézier curve. We show that the LN curve has an approximation order of 2m+2$2m+2$, for m=2,3$m=2,3$. Our approximation method can be applied to offset approximation, so obtaining a rational Bézier curve as an offset approximant. We derive an algorithm for offset approximation based on the LN circle approximation and illustrate our method with some numerical examples.     

Quadrature for hp-Galerkin BEM in {\hbox{\sf l\kern-.13em R}}^3

Summary. The Galerkin discretization of a Fredholm integral equation of the second kind on a closed, piecewise analytic surface is analyzed. High order, -boundary elements on grids which are geometrically graded toward the edges and vertices of the surface give exponential convergence, similar to what is known in the -Finite Element Method. A quadrature strategy is developed which gives rise to a fully discrete scheme preserving the exponential convergence of the -Boundary Element Method. The total work necessary for the consistent quadratures is shown to grow algebraically with the number of degrees of freedom. Numerical results on a curved polyhedron show exponential convergence with respect to the number of degrees of freedom as well as with respect to the CPU-time. Received April 22, 1996     

Domain imbedding methods for the Stokes equations

Summary We study direct and iterative domain imbedding methods for the Stokes equations on certain non-rectangular domains in two space dimensions. We analyze a continuous analog of numerical domain imbedding for bounded, smooth domains, and give an example of a simple numerical algorithm suggested by the continuous analysis. This algorithms is applicable for simply connected domains which can be covered by rectangular grids, with uniformly spaced grid lines in at least one coordinate direction. We also discuss a related FFT-based fast solver for Stokes problems with physical boundary conditions on rectangles, and present some numerical results.