236U AMS measurement at CIRCE

In order to measure the isotopic ratio of actinides,the upgrade of the accelerator mass spectrometry system at the Center for Isotopic Research on Cultural and Environmental heritage at the Second University of Naples,Italy,was performed.The beam emittance of 238U and the isotopic abundance sensitivity of 236U were measured on the present beam line.Utilizing a 16-strip silicon detector,the sensitivity of 236U/238U≈ 1×10-11 was obtained.     

Alternating forward–backward splitting for linearly constrained optimization problems

Optimization Letters - We present an alternating forward–backward splitting method for solving linearly constrained structured optimization problems. The algorithm takes advantage of the...     

Urinary Metabolomics Study of Patients with Bicuspid Aortic Valve Disease

Bicuspid aortic valve (BAV) is the most common congenital heart defect responsible for valvular and aortic complications in affected patients. Causes and mechanisms of this pathology are still elusive and thus the lack of early detection biomarkers leads to challenges in its diagnosis and prevention of associated cardiovascular anomalies. The aim of this study was to explore the potential use of urine Nuclear Magnetic Resonance (NMR) metabolomics to evaluate a molecular fingerprint of BAV. Both multivariate and univariate statistical analyses were performed to compare the urinary metabolome of 20 patients with BAV with that of 24 matched controls. Orthogonal partial least squared discriminant analysis (OPLS-DA) showed statistically significant discrimination between cases and controls, suggesting seven metabolites (3-hydroxybutyrate, alanine, betaine, creatine, glycine, hippurate, and taurine) as potential biomarkers. Among these, glycine, hippurate and taurine individually displayed medium sensitivity and specificity by receiver operating characteristic (ROC) analysis. Pathway analysis indicated two metabolic pathways likely perturbed in BAV subjects. Possible contributions of gut microbiota activity and energy imbalance are also discussed. These results constitute encouraging preliminary findings in favor of the use of urine-based metabolomics for early diagnosis of BAV.     

Magnetic-field-induced quantum criticality in a spin-<Emphasis Type="Italic">S</Emphasis> planar ferromagnet with single-ion anisotropy

The effects of single-ion anisotropy on quantum criticality in a d-dimensional spin-S planar ferromagnet is explored by means of the two-time Green’s function method. We work at the Tyablikov decoupling level for exchange interactions and the Anderson-Callen decoupling level for single-ion anisotropy. In our analysis a longitudinal external magnetic field is used as the non-thermal control parameter and the phase diagram and the quantum critical properties are established for suitable values of the single-ion anisotropy parameter D. We find that the single-ion anisotropy has sensible effects on the structure of the phase diagram close to the quantum critical point. However, for values of the uniaxial crystal-field parameter below a positive threshold, the conventional magnetic-field-induced quantum critical scenario remains unchanged.     

On the Cauchy Problem for Hyperbolic Operators with Double Characteristics

We show that for a class of hyperbolic second order operators with double characteristics the Ivrii–Petkov condition is also sufficient for the well-posedness of the Cauchy problem in C ^∞.     

Geometric gradient-flow dynamics with singular solutions

The gradient-flow dynamics of an arbitrary geometric quantity is derived using a generalization of Darcy’s Law. We consider flows in both Lagrangian and Eulerian formulations. The Lagrangian formulation includes a dissipative modification of fluid mechanics. Eulerian equations for self-organization of scalars, 1-forms and 2-forms are shown to reduce to nonlocal characteristic equations. We identify singular solutions of these equations corresponding to collapsed (clumped) states and discuss their evolution.     

Geometry of Vlasov kinetic moments: A bosonic Fock space for the symmetric Schouten bracket

The dynamics of Vlasov kinetic moments is shown to be Lie-Poisson on the dual Lie algebra of symmetric contravariant tensor fields. The corresponding Lie bracket is identified with the symmetric Schouten bracket and the moment Lie algebra is related with a bundle of bosonic Fock spaces, where creation and annihilation operators are used to construct the cold plasma closure. Kinetic moments are also shown to define a momentum map, which is infinitesimally equivariant. This momentum map is the dual of a Lie algebra homomorphism, defined through the Schouten bracket. Finally the moment Lie-Poisson bracket is extended to anisotropic interactions.     

Synthetic Receptors with Micromolar Affinity for Chloride in Water

A water-soluble coordination cage was obtained by reaction of Pd(NO₃)₂ with a 1,3-di(pyridin-3-yl)benzene ligand featuring a short PEG chain. The cavity of the metal-organic cage contains one nitrate anion, which is readily replaced by chloride. The apparent association constant for chloride binding in buffered aqueous solution is K_a=1.8(±0.1)×10⁵ M⁻¹. This value is significantly higher than what has been reported for other macrocyclic chloride receptors. The heavier halides Br⁻ and I⁻ compete with binding or self-assembly, but the receptor displays very good selectivity over common anions such as phosphate, acetate, carbonate, and sulfate. A further increase of the chloride binding affinity by a factor of 3 was achieved using a fluorinated dipyridyl ligand.     

Water dissociation at MgO sub-monolayers on silver: a periodic model study

A hybrid-exchange DFT hamiltonian and a periodic slab model have been employed to simulate water dissociation at the border of sub-monolayer MgO films deposited on Ag(100). Non-polar and polar borders have been considered, but the reaction energy is higher in the former case. The O-1s core level shifts and the O-H vibrational frequencies have been calculated and shown to be compatible with recent XPS and HREELS data, respectively [Savio et al., J. Chem. Phys., 2003, 119, 12053].     

Recent Advances in the Synthesis of Polyamine Derivatives and Their Applications

Biogenic polyamines (PAs) are involved in the growth and development of normal cells, and their intracellular concentration is stable. The concentration of PAs in cancer cells is significantly increased to promote and sustain their rapid proliferation. Over the years, synthetic PAs, which differ in their structure, have demonstrated high antitumor activity and are involved in clinical trials. The chemical synthesis of PAs and their conjugates require the correct choice of synthetic pathways—methods for constructing conjugates and the orthogonal protection of amino groups. The most common methods of synthesis of PA conjugates are acylation of regioselectively protected PAs or their alkylation under the conditions of the Fukuyama reaction. One of the most promising methods of PA synthesis is the use of a multicomponent Ugi reaction, which allows various PAs to be obtained in high yields. In this review, we describe and analyze various approaches that are used in the synthesis of polyamines and their conjugates.