Eine Bemerkung über Pfisterformen

Ohne Zusammenfassung     

The Torsional Stability Around a Single Bond Analyzed by Extended Hückel Orbital Forces

A simple pencil and paper method to calculate the forces acting on individual atoms in a molecule, due to the electrons in the different populated molecular orbitals, has been developed within the Extended Hückel formalism. The method is applied to study the torsional stability around a single bond of some simple molecules. The results show good agreement with the experimental evidence of stable conformers.     

Existence of glueballs in strongly coupled lattice gauge theories

It is shown that the plaquette-plaquette correlation functions in pure lattice gauge theories exhibit an isolated simple pole in the complex energy variable for large-coupling constants. This implies the existence of isolated one-particle (glueball) states in the space of “boxitons”.     

Identification of Two New Phosphorylated Polyketides from a Brazilian Streptomyces sp. Through the Use of LC–SPE/NMR

Two new polyketide phosphate monoesters, phosdiecin A ( 1 ) and phosdiecin B ( 2 ), were isolated from a culture of the marine Streptomyces sp. SS99BA‐2 using the hyphenated technology LC–SPE/NMR. The compounds showed to be new representatives of an important class of antitumor antibiotic metabolites known as fostriecins. Their structures, including relative configuration attribution, were fully elucidated through extensive analyses of NMR and MALDI‐TOF/TOF HR‐MS data. Herein, the application of this system to isolate and identify the new compounds is described.     

Simultaneous monitoring of monoamines,amino acids,nucleotides and neuropeptides by liquid chromatography‐tandem mass spectrometry and its application to neurosecretion in bovine chromaffin cells

The primary functions of adrenal medullary chromaffin cells are the synthesis and storage in their chromaffin vesicles of the catecholamines noradrenaline (NA) and adrenaline (AD), and their subsequent release into the bloodstream by Ca²⁺‐dependent exocytosis under conditions of fear or stress (fight or flight response). Several monoamines, nucleotides and opiates, such as leucine‐enkephalin (LENK) and methionine‐enkephalin (MENK), are also co‐stored and co‐released with the catecholamines. However, other neurotransmitters have not been studied in depth. Here, we present a novel high‐resolution liquid chromatography‐tandem mass spectrometry approach for the simultaneous monitoring of 14 compounds stored and released in bovine chromaffin cells (BCCs). We validated the analytical method according to the recommendations of the EMA and FDA by testing matrix effect, selectivity, sensitivity, precision, accuracy, stability and carry‐over. After testing on six batches of BCCs from different cultures, the method enabled simultaneous quantitative determination of monoamines (AD, NA, dopamine, serotonin, 5‐hydroxyindoleacetic acid, histamine and metanephrine), amino acids (L‐glutamic acid, γ‐aminobutyric acid), nucleotides (adenosine 5′‐diphosphate, adenosine 5′‐monophosphate, cyclic adenosine 5′‐monophosphate) and neuropeptides (LENK and MENK) in the intracellular content, basal secretion and acetylcholine induced secretion of BBCs. The high‐resolution approach used here enabled us to determine the levels of 14 compounds in the same BCC batch in only 16 min. This novel approach will make it possible to study the regulatory mechanisms of Ca²⁺ signaling, exocytosis and endocytosis using different neurotrophic factors and/or secretagogues as stimuli in primary BCC cultures. Our method is actually being applied to human plasma samples of different therapeutic areas where sympathoadrenal axis is involved in stress situations such as Alzheimer's disease, migraine or cirrhosis, to improve diagnosis and clinical practice. Copyright © 2016 John Wiley & Sons, Ltd.     

High-Order AFEM for the Laplace–Beltrami Operator: Convergence Rates

We present a new AFEM for the Laplace–Beltrami operator with arbitrary polynomial degree on parametric surfaces, which are globally \(W^1_\infty \) and piecewise in a suitable Besov class embedded in \(C^{1,\alpha }\) with \(\alpha \in (0,1]\). The idea is to have the surface sufficiently well resolved in \(W^1_\infty \) relative to the current resolution of the PDE in \(H^1\). This gives rise to a conditional contraction property of the PDE module. We present a suitable approximation class and discuss its relation to Besov regularity of the surface, solution, and forcing. We prove optimal convergence rates for AFEM which are dictated by the worst decay rate of the surface error in \(W^1_\infty \) and PDE error in \(H^1\).     

Nuclear Structure then and now: 40 years of the 1975 Nobel Prize in Physics

The findings for which Aage Bohr and Ben R. Mottelson became co‐winners of the 1975 Nobel Prize in physics provided the basis for what can be called the second discovery of the atomic nucleus. They found that in this self‐bound microscopic system made out of nucleons, collective and independent‐particle motion, typical of a liquid drop and of planetary motion respectively, emerge from the same components of the strong force, their interweaving leading to phase transitions which can be studied in terms of individual quantal states. 1     

Specific Heat Anomalies in Solids Described by a Multilevel Model

In the field of condensed matter physics, specific heat measurements can be considered as a pivotal experimental technique for characterizing the fundamental excitations involved in a certain phase transition. Indeed, phase transitions involving spin (de Souza et al. Phys. B Condens. Matter 404, 494 (2009) and Manna et al. Phys. Rev. Lett. 104, 016403 (2010)), charge (Pregelj et al. Phys. Rev. B 82, 144438 (2010)), lattice (Jesche et al. Phys. Rev. B 81, 134525 (2010)) (phonons) and orbital degrees of freedom, the interplay between ferromagnetism and superconductivity (Jesche et al. Phys. Rev. B 86, 020501 (2012)), Schottky-like anomalies in doped compounds (Lagos et al. Phys. C Supercond. 309, 170 (1998)), electronic levels in finite correlated systems (Macedo and Lagos J. Magn. Magn. Mater. 226, 105 (2001)), among other features, can be captured by means of high-resolution calorimetry. Furthermore, the entropy change associated with a first-order phase transition, no matter its nature, can be directly obtained upon integrating the specific heat over T, i.e., C(T)/T, in the temperature range of interest. Here, we report on a detailed analysis of the two-peak specific heat anomalies observed in several materials. Employing a simple multilevel model, varying the spacing between the energy levels Δ_i = (E_i?E₀) and the degeneracy of each energy level g_i, we derive the required conditions for the appearance of such anomalies. Our findings indicate that a ratio of \({\Delta }_{2}/{\Delta }_{1}\thickapprox \) 10 between the energy levels and a high degeneracy of one of the energy levels define the two-peaks regime in the specific heat. Our approach accurately matches recent experimental results. Furthermore, using a mean-field approach, we calculate the specific heat of a degenerate Schottky-like system undergoing a ferromagnetic (FM) phase transition. Our results reveal that as the degeneracy is increased the Schottky maximum in the specific heat becomes narrow while the peak associated with the FM transition remains unaffected.     

The role of cyclodextrins in chiral capillary electrophoresis

The members of the enantiomeric pairs frequently show rather different biological effects, so their chiral selective synthesis, pharmacological studies and analysis are necessary. CE has unique advantages in chiral analysis. The most frequently used chiral selectors are CDs in this field. This paper gives a short view on the advantages on CE in direct chiral separations, emphasizing the role of CDs. The reason for the broad selectivity spectra of CDs is discussed in detail. The physical background of chiral selective separations is briefly shown in CE. Their interaction mechanisms are shortly defined. The general trend of their use is statistically evaluated. Most frequently used CDs and CD derivatives are characterized. Advantages of ionizable CDs and single-isomer derivatives are shown. The general trend of their use is established.     

Synthesis of new chiral ionic liquids based on (−)-menthol and (−)-borneol

New chiral ionic liquids (CILs) based on (−)-menthol and (−)-borneol were designed and synthesized in very good yields using a simple and efficient 3-step strategy. The properties and characterization of these compounds are discussed.