A survey of the behavior of the hydroxybisphosphonic function in crystallized acids,metallic salts,and some related compounds

The flexibility and the different degrees of ionization of the hydroxybisphosphonic function provide numerous possibilities for the complexation of metallic and organic cations to molecules possessing these functions. The properties of this class of compounds are very interesting for different industrial and medical applications. They depend in a large part on the nature of the hydrocarbonated chain substituted to CH₃ in hydroxyethylidenebisphosphonic acid and of the number and the position of the bisphosphonic groups grafted on this chain. © 2001 John Wiley & Sons, Inc. Heteroatom Chem 12:73–89, 2001     

Self-assembled nanocages for hydrophilic guest molecules

Reverse polymeric micelles are obtained following the association of polymeric amphiphiles in apolar media. To this date, reports of pharmaceutical applications for such micelles have been scarce, mainly because these systems have been studied in solvents that are not suitable for medical use. Here, alkylated star-shaped poly(glycerol methacrylate) polymers have been proposed in the design of oil-soluble reverse polymeric micelles. Micellar behavior was studied in various apolar solvents, including ethyl oleate, a pharmaceutically acceptable vehicle. The polymers were shown to assemble into spherical nanostructures (<40 nm) as determined by cryogenic transmission electron microscopy and atomic force microscopy studies. Interestingly, the reverse micelles were able to encapsulate various peptides/proteins (vasopressin, myoglobin, and albumin) in substantial amounts and facilitate their solubilization in oil. The nature of both the polymer used in micelle formation and the guest molecules was found to influence the ability of the micelle to interact with hydrophilic compounds.     

Numerical discrimination of intrachannel cross-phase modulation and intrachannel four-wave mixing and their respective effect on 40 Gbit/s transmissions

We propose a numerical method to accurately discriminate the influence of the different intrachannel nonlinear effects occurring in 40 Gbit/s optical transmissions, following an analogy with methods used to discriminate WDM interchannel effects. In contrast to other studies showing the predominance of intrachannel cross-phase modulation when low-dispersion fibers are used, in our study intrachannel four-wave mixing is the most penalizing effect in all investigated cases.     

Reference map technique for finite-strain elasticity and fluid–solid interaction

The reference map, defined as the inverse motion function, is utilized in an Eulerian-frame representation of continuum solid mechanics, leading to a simple, explicit finite-difference method for solids undergoing finite deformations. We investigate the accuracy and applicability of the technique for a range of finite-strain elasticity laws under various geometries and loadings. Capacity to model dynamic, static, and quasi-static conditions is shown. Specifications of the approach are demonstrated for handling irregularly shaped and/or moving boundaries, as well as shock solutions. The technique is also integrated within a fluid–solid framework using a level-set to discern phases and using a standard explicit fluid solver for the fluid phases. We employ a sharp-interface method to institute the interfacial conditions, and the resulting scheme is shown to efficiently capture fluid–solid interaction solutions in several examples.     

Rayleigh–Schrödinger series and Birkhoff decomposition

We derive new expressions for the Rayleigh–Schrödinger series describing the perturbation of eigenvalues of quantum Hamiltonians. The method, somehow close to the so-called dimensional renormalization in quantum field theory, involves the Birkhoff decomposition of some Laurent series built up out of explicit fully non-resonant terms present in the usual expression of the Rayleigh–Schrödinger series. Our results provide new combinatorial formulae and a new way of deriving perturbation series in quantum mechanics. More generally we prove that such a decomposition provides solutions of general normal form problems in Lie algebras.     

Viewing Angle and Imaging Polarization Analysis of Liquid Crystal Displays and Their Components

Optical characterization of all types of displays is mandatory to quantify the different imperfections and compare the different technologies. Standard characterization is focused on luminance and color measurements of the light emitted by the displays. Viewing angle measurements devoted to the angular characterization and homogeneity measurements are the most frequently used. In the present paper we demonstrate that the same type of measurements extended to the polarization analysis of the light emitted by the display can be a powerful tool in order to understand the origin of many imperfections. The present paper is composed of two main parts: first the different measurement tools for viewing angle and imaging characterization are presented and the method used to analyze the polarization state of the light is explained. The second part gives details on some examples of applications for the characterization of display components (brightness enhancement film, backlight), the measurement of the crystal cell rotation inside a standard LCD display, and the characterization of a passive 3D TV.     

Contact analysis in the presence of an ellipsoidal inhomogeneity within a half space

Many materials contain inhomogeneities or inclusions that may greatly affect their mechanical properties. Such inhomogeneities are for example encountered in the case of composite materials or materials containing precipitates. This paper presents an analysis of contact pressure and subsurface stress field for contact problems in the presence of anisotropic elastic inhomogeneities of ellipsoidal shape. Accounting for any orientation and material properties of the inhomogeneities are the major novelties of this work. The semi-analytical method proposed to solve the contact problem is based on Eshelby’s formalism and uses 2D and 3D Fast Fourier Transforms to speed up the computation. The time and memory necessary are greatly reduced in comparison with the classical finite element method. The model can be seen as an enrichment technique where the enrichment fields from the heterogeneous solution are superimposed to the homogeneous problem. The definition of complex geometries made by combination of inclusions can easily be achieved. A parametric analysis on the effect of elastic properties and geometrical features of the inhomogeneity (size, depth and orientation) is proposed. The model allows to obtain the contact pressure distribution – disturbed by the presence of inhomogeneities – as well as subsurface and matrix/inhomogeneity interface stresses. It is shown that the presence of an inclusion below the contact surface affects significantly the contact pressure and subsurfaces stress distributions when located at a depth lower than 0.7 times the contact radius. The anisotropy directions and material data are also key elements that strongly affect the elastic contact solution. In the case of normal contact between a spherical indenter and an elastic half space containing a single inhomogeneity whose center is located straight below the contact center, the normal stress at the inhomogeneity/matrix interface is mostly compressive. Finally when the axes of the ellipsoidal inclusion do not coincide with the contact problem axes, the pressure distribution is not symmetrical.     

Targeting bacterial toxins

Protein toxins constitute the main virulence factors of several species of bacteria and have proven to be attractive targets for drug development. Lead candidates that target bacterial toxins range from small molecules to polymeric binders, and act at each of the multiple steps in the process of toxin-mediated pathogenicity. Despite recent and significant advances in the field, a rationally designed drug that targets toxins has yet to reach the market. This Review presents the state of the art in bacterial toxin targeted drug development with a critical consideration of achieved breakthroughs and withstanding challenges. The discussion focuses on A-B-type protein toxins secreted by four species of bacteria, namely Clostridium difficile (toxins A and B), Vibrio cholerae (cholera toxin), enterohemorrhagic Escherichia coli (Shiga toxin), and Bacillus anthracis (anthrax toxin), which are the causative agents of diseases for which treatments need to be improved.     

Dynamics of fluorescence depolarisation in star-shaped oligofluorene-truxene molecules

Star-shaped molecules are of growing interest as organic optoelectronic materials. Here a detailed study of their photophysics using fluorescence depolarisation is reported. Fluorescence depolarisation dynamics are studied in branched oligofluorene-truxene molecules with a truxene core and well-defined three-fold symmetry, and are compared with linear fluorene oligomers. An initial anisotropy value of 0.4 is observed which shows a two-exponential decay with time constants of 500 fs and 3-8 ps in addition to a long-lived component. The femtosecond component is attributed to exciton localisation on one branch of the molecule and its amplitude reduces when the excitation is tuned to the low energy tail of the absorption spectrum. The picosecond component shows a weak dependence on the excitation wavelength and is similar to the calculated rate of the resonant energy transfer of the localised exciton between the branches. These assignments are supported by density-functional theory calculations which show a disorder-induced splitting of the two degenerate excited states. Exciton localisation is much slower than previously reported in other branched molecules which suggests that efficient light-harvesting systems can be designed using oligofluorenes and truxenes as building blocks.