Preconcentration and determination of five antidepressants from human milk and urine samples by stir bar filled magnetic ionic liquids using liquid–liquid–liquid microextraction-high-performance liquid chromatography

A sensitive and straightforward liquid–liquid–liquid microextraction method was developed to preconcentrate and cleanup antidepressants, including mirtazapine, venlafaxine, escitalopram, fluoxetine, and fluvoxamine, from biological samples before analyzing with high-performance liquid chromatography. The essential novelty of this study is using magnetic ionic liquids as the extraction phase in the lumen of hollow fiber and preparing a liquid magnetic stir bar. In this method, polypropylene hollow fiber was utilized as the permeable membrane for the analyte extraction. Six magnetic ionic liquids consisting of the transition metal and rare earth compounds were synthesized and then hollow fiber lumen was injected as acceptor phase to extract the antidepressants. Besides, 3-pentanol as a water-immiscible solvent was impregnated in the hollow fiber wall pores. The effective factors in the method were optimized with the central composition design. The resultant calibration curves were linear over the concentration range of 0.8–400.0 ng mL⁻¹ (R² ≥ 0.996). The method displayed the proper detection limit (0.11–0.24 ng mL⁻¹), the reasonable limit of quantification (≤0.79 ng mL⁻¹), wide linear ranges, high preconcentration factors (≥294.3), and suitable relative standard deviation (2.31–5.47%) for measuring antidepressant medications. Analysis of human milk and urine samples showed acceptable recoveries of 96.5–103.8% with excellent relative standard deviations lower than 5.95%.     

Fej\'{e}r type inequalities for Harmonically-convex functions with applications

In this paper, a new weighted identity involving harmonically symmetric functions and differentiable functions is established. By using the notion of harmonic symmetricity, harmonic convexity and some auxiliary results, some new Fej\''{e}r type integral inequalities are presented. Applications to special means of positive real numbers are given as well.     

Phenomenological local potential analysis of π+ scattering

π⁺-nucleus scattering cross section are calculated by solving a Schrödinger equation reduced from the Klein-Gordon equation. Local potentials are assumed, and phenomenological potential parameters are searched energy dependently for π⁺ scattering from ¹²C, ⁴⁰Ca, and ²⁰⁸Pb to reproduce not only differential elastic cross sections but also inelastic and total and reaction cross sections at 800 MeV/c pion laboratory momentum. The collective model is used to calculate the angular distributions of differential inelastic cross sections for pions leading to the lowest 2⁺ and 3^? states of ¹²C. The deformation parameters and lengths are extracted and compared to the corresponding ones from other works. Local potentials well describe the scattering of pions from nuclei.     

Second-order variational analysis in second-order cone programming

Mathematical Programming - The paper conducts a second-order variational analysis for an important class of nonpolyhedral conic programs generated by the so-called second-order/Lorentz/ice-cream...     

π-Stacking effects on acid capacity of p-aminobenzoic acid

Structural Chemistry - Acidity changes of p-aminobenzoic acid (pABA) after π-stacking with substituted benzenes (SB) have been investigated using quantum mechanical calculations at the...     

Integrating thermal-concentration smoothed profile with lattice Boltzmann methods for simulating sedimentation of nonisothermal circular particles

A thermal-concentration smoothed profile-lattice Boltzmann method is proposed to study the effect of the concentration field on the dynamic behavior of nonisothermal cylindrical particles during the sedimentation process. The velocity, temperature, and concentration equations are solved using the lattice Boltzmann method. Moreover, the smoothed profile method is employed to enforce the nonslip boundary condition as well as constant temperature and constant concentration boundary conditions at the particles surfaces. Moreover, the Boussinesq approximation is used to couple the velocities, temperatures, and concentrations fields. The proposed combined method is validated by comparing the present numerical results with those found in the literature, showing good consistency. Then, the effect of the concentration buoyancy on the behavior of nonisothermal particles is discussed. In addition, the effect of Prandtl, Schmidt, and thermal Grashof numbers on the settling process is investigated. The results show that, by adding the effect of concentration, the maximum settling velocity of hot particles is reduced more relative to the cold ones; accordingly, the cold particles are settled faster than the hot ones. Finally, the sedimentation of two particles in a container at high thermal Grashof is investigated. It is shown that, at high thermal Grashof, there is an intense competition between the buoyancy force and gravity for the hot particles. The buoyancy flow generated leads to the reversal of the drafting-kissing-tumbling motion of the hot particles, making the particles move upward.     

Dynamic stability of functionally graded cantilever cylindrical shells under distributed axial follower forces

In this paper, flutter of functionally graded material (FGM) cylindrical shells under distributed axial follower forces is addressed. The first-order shear deformation theory is used to model the shell, and the material properties are assumed to be graded in the thickness direction according to a power law distribution using the properties of two base material phases. The solution is obtained by using the extended Galerkin's method, which accounts for the natural boundary conditions that are not satisfied by the assumed displacement functions. The effect of changing the concentrated (Beck's) follower force into the uniform (Leipholz's) and linear (Hauger's) distributed follower loads on the critical circumferential mode number and the minimum flutter load is investigated. As expected, the flutter load increases as the follower force changes from the so-called Beck's load into the so-called Leipholz's and Hauger's loadings. The increased flutter load was calculated for homogeneous shell with different mechanical properties, and it was found that the difference in elasticity moduli bears the most significant effect on the flutter load increase in short, thick shells. Also, for an FGM shell, the increase in the flutter load was calculated directly, and it was found that it can be derived from the simple power law when the corresponding increase for the two base phases are known.     

Interaction of zanamivir with DNA and RNA: Models for drug–DNA and drug–RNA bindings

Zanamivir (ZAN) is the first of a new generation of influenza virus-specific drugs known as neuraminidase inhibitors, which acts by interfering with life cycles of influenza viruses A and B. It prevents the virus spreading infection to other cells by blocking the neuraminidase enzyme present on the surface of the virus. The aim of this study was to examine the stability and structural features of calf thymus DNA and yeast RNA complexes with zanamivir in aqueous solution, using constant DNA or RNA concentration (12.5 mM) and various zanamivir/polynucleotide (P) ratios of 1/20, 1/10, 1/4, and 1/2. FTIR and UV–visible spectroscopy are used to determine the drug external binding modes, the binding constant and the stability of zanamivir–DNA and RNA complexes in aqueous solution. Structural analysis showed major interaction of zanamivir with G-C (major groove) and A-T (minor groove) base pairs and minor perturbations of the backbone PO₂ group with overall binding constants of K_{zanamivir–DNA} = 1.30 × 10⁴ M⁻¹ and K_{zanamivir–RNA} = 1.38 × 10⁴ M⁻¹. The drug interaction induces a partial B to A-DNA transition, while RNA remains in A-conformation.