Three-loop anomalous dimensions for squarks in supersymmetric QCD

In this Letter we evaluate the renormalization constants and anomalous dimensions for the squark wave function and mass within supersymmetric QCD. These results complement the ones obtained in Harlander et al. (2009) [1] and thus provide further confirmation on the applicability of dimensional reduction to supersymmetric QCD at three-loop order. The three-loop anomalous dimension constitute important input to precision predictions of the supersymmetric mass spectrum as obtained from the evolution from the GUT to the TeV energy scale.     

Thermal Behaviour of Some Polyhydrocarboxylic Coordination Compounds with Neodium

New Nd-Co based polynuclear coordination compounds containing as ligand polyhydrocarboxylic acid as tartaric, malic and gluconic acids were prepared, namely: [NdCo(tart)₃]·4H₂O, (NH₄)[NdCo_0.5Cu_0.5(tart)₃]·4H₂O, (NH₄)[NdCo(malic)₃]·4H₂O, (NH₄)[NdCo_0.5Cu_0.5(malic)₃]·4H₂O, [NdCo(gluc)₄]·4H₂O and [Nd₂CoCu(gluc)₇]·5H₂O. A comparison between the thermal behaviour of the studied polynuclear coordination compounds concerning thermal stability and thermal decomposition stoichiometry was inferred. Oxalic and malonic intermediates were identified at about 300°C in the thermal decomposition of tartaric and malic compounds. In all the decomposition processes at about 400°C the presence of oxocarbonate is shown. The residual products are mixed oxides of perovskite type. This revised version was published online in August 2006 with corrections to the Cover Date.     

PAN composite membrane with different solvent affinities controlled by surface modification methods

Polyacrylonitrile (PAN) composite membranes with surface properties designed by either a chemical modification with ethylenediamine (EDA), or layer‐by‐layer (LbL) polyelectrolyte adsorption were investigated in this paper. Fourier‐transformed infrared (FTIR) spectroscopy and streaming potential measurements showed that the first step of the reaction with EDA in gas phase was the formation of ammonium salts with the reactive carboxylic groups present on the surface of the starting membrane. Part of the ammonium carboxylate groups was transformed in secondary amide linkages by a heat‐induced reaction. Poly(sodium styrenesulfonate) (NaPSS) and a polycation containing about 95 mol % of N,N‐dimethyl‐2‐hydroxypropyleneammonium chloride units in the backbone (PCA₅) were used as opposite polyions in the LbL film construction. The adsorbed polyion amount per every layer was controlled by the nature and concentration of the supporting electrolyte in polyelectrolyte deposition solution (NaBr and KBr). An almost linear increase of the adsorbed polyion amount versus the layer pair number was observed. The swelling degree (SD) in pure alcohols of the LbL‐modified PAN composite membrane decreased with the increase of the solvent polarity and with the decrease of the pore volume by pore filling with polyelectrolyte complex multilayer. © 2005 Wiley Periodicals, Inc. J Polym Sci Part A: Polym Chem 43: 4161–4171, 2005     

Investigation of the interface in silica-encapsulated liposomes by combining solid state NMR and first principles calculations

In the context of nanomedicine, liposils (liposomes and silica) have a strong potential for drug storage and release schemes: such materials combine the intrinsic properties of liposome (encapsulation) and silica (increased rigidity, protective coating, pH degradability). In this work, an original approach combining solid state NMR, molecular dynamics, first principles geometry optimization, and NMR parameters calculation allows the building of a precise representation of the organic/inorganic interface in liposils. {(1)H-(29)Si}(1)H and {(1)H-(31)P}(1)H Double Cross-Polarization (CP) MAS NMR experiments were implemented in order to explore the proton chemical environments around the silica and the phospholipids, respectively. Using VASP (Vienna Ab Initio Simulation Package), DFT calculations including molecular dynamics, and geometry optimization lead to the determination of energetically favorable configurations of a DPPC (dipalmitoylphosphatidylcholine) headgroup adsorbed onto a hydroxylated silica surface that corresponds to a realistic model of an amorphous silica slab. These data combined with first principles NMR parameters calculations by GIPAW (Gauge Included Projected Augmented Wave) show that the phosphate moieties are not directly interacting with silanols. The stabilization of the interface is achieved through the presence of water molecules located in-between the head groups of the phospholipids and the silica surface forming an interfacial H-bonded water layer. A detailed study of the (31)P chemical shift anisotropy (CSA) parameters allows us to interpret the local dynamics of DPPC in liposils. Finally, the VASP/solid state NMR/GIPAW combined approach can be extended to a large variety of organic-inorganic hybrid interfaces.     

Weak-operator Continuity and the Existence of Adjoints

It is shown, within constructive mathematics, that the unit ball B₁(H) of the set of bounded operators on a Hilbert space H is weak-operator totally bounded. This result is then used to prove that the weak-operator continuity of the mapping T → AT on B₁(H) is equivalent to the existence of the adjoint of A.     

Segmentation under geometrical conditions using geodesic active contours and interpolation using level set methods

Let I: be a given bounded image function, where is an open and bounded domain which belongs to ⁿ. Let us consider n=2 for the purpose of illustration. Also, let S={x_i}_i be a finite set of given points. We would like to find a contour , such that is an object boundary interpolating the points from S. We combine the ideas of the geodesic active contour (cf. Caselles et al. [7,8]) and of interpolation of points (cf. Zhao et al. [40]) in a level set approach developed by Osher and Sethian [33]. We present modelling of the proposed method, both theoretical results (viscosity solution) and numerical results are given. AMS subject classification 49L25, 74G65, 68U10     

Modifications Induced by UV-Vis Irradiation on DNA Extract of Kiwifruit Investigated by Spectroscopic and Statistic Methods

ABSTRACT

Revealing molecular alterations induced on kiwifruit under UV-Vis irradiation requires a discussion of biochemical-cell infrared (IR) fingerprint (900 cm^?1–1800 cm^?1) bands characteristic of nucleic acids. FTIR-ATR spectroscopy and statistics and nondestructive methods for screening exposure effects induced by irradiation were used. There the irradiation influence on the main molecular bonds (i.e., ν(C-C), ν_s(PO₂?) and ν_as(PO₂?)) can be observed. Regression methods were used for statistical investigations. Two categories of variables were used: the absorbance measured at fixed wavenumber variables and the exposure dose. The bivariate correlations, partial correlations, and polynomial regression methods from SPSS were used for statistical investigations. The obtained results show that FTIR-ATR, in correlation with statistics techniques, might be useful to assess immediate radiation and oxidative-induced damage to nucleic acids. In this case IR spectroscopy can be used successfully to study conformational changes during DNA reversible denaturation especially on the sugar-phosphate vibrations domain.     

Diarylthiazole and diarylimidazole selective COX-1 inhibitor analysis through pharmacophore modeling,virtual screening,and DFT-based approaches

Structural Chemistry - The current work is focused on in silico modeling of COX-1 inhibitors with enhanced safety gastric profile. A 5-point pharmacophore model, atom-based 3D quantitative...