RKKY interaction in the zigzag-edge silicene-like nanoflake

By considering the Kane-Mele-Hubbard approximation on the honeycomb lattice, we investigate the spin-spin correlation for two magnetic impurities in zigzag edge silicene-like nanoflake (ZSiLF). The dependence of the spatial behaviors of RKKY interaction on the electron-electron (e-e), intrinsic spin-orbit interactions (ISOI) and, electric field are systematically investigated. Generally, the spatial behaviors of the RKKY interaction sensitively change by changing e-e interaction and electric field strengths in the presence of ISOI. The ISOI in a ZSiLF result in long-range in-plane and Ising interactions. Moreover, e-e interaction induces non-zero Dzyaloshinsky-Moriya (DM) term and nearly distance-independent Ising interaction (similar to graphene nanoflake) in the presence of ISOI. Furthermore, with considering e-e interaction, the in-plane DM interaction increases by increasing the strengths of the electric field and ISOI.     

The study of the weibel electromagnetic instability growth rate in the presence of the body stress

Body stress flow can be expected in the fast ignition imploding of the inertial fusion process that strongly damps small‐scale velocity structures. The Weibel instability is one of the plasma instabilities that require anisotropy in the distribution function. The body stress effect was neglected in the calculation of the Weibel instability growth rate. In this article, the propagation condition of impinging waves and the growing modes of the Weibel instability on the plasma density gradient of the fuel fusion with the body stress flow are investigated. Calculations show that the minimum value of the body stress rate threshold in the linear polarization is about 2.96 times greater than that of the circular polarization. Increasing 10 times of the density gradient and decreasing 2 times of the wavelength in the linear polarization and the circular polarization, respectively, lead to about 1.78 × 10⁶ times increment and 0.019 times decrement in the maximum of the Weibel instability growth rate. Also, the Weibel instability growth rate maximum in the circular polarization is about 10⁷ times greater than that of the linear polarization. The body stress flow and the density gradient tend to stabilize the Weibel instability in the circular polarization and act as a destabilizing source in the linear polarization. Therefore, by increasing steps of the density gradient plasma near the relativistic electron beam‐emitting region, in the circular polarization, the Weibel instability occurs at a higher stress flow.     

A combination of molecular docking,receptor-guided QSAR,and molecular dynamics simulation studies of S-trityl-l-cysteine analogues as kinesin Eg5 inhibitors

Structural Chemistry - Kinesin Eg5 plays an essential role in the early stages of mitosis, and it is an interesting drug target for the design of potent inhibitors. In this work, combined molecular...     

Lipid-DNA conjugates for cell membrane modification,analysis, and regulation

ABSTRACT

Lipids and DNAs are two major building blocks of life. Interestingly, by chemically linking these two natural compounds together, synthetic lipid-DNA conjugates exhibit several attractive features for cell membrane studies. These lipid-DNA conjugates are amphiphilic macromolecules combining the cell membrane insertion capability of lipids with the properties of DNAs in precise hybridization and programmability. These supramolecular conjugates have demonstrated exciting applications from generating cell membrane nanopores to transmembrane cargo deliveries, and from analyzing cell membrane events to tissue engineering. In this review, we will discuss the design, structures, and biological applications of lipid-DNA conjugates, with an emphasis on their functions on live cell membranes. We expect, in the near future, significant advancement in our ability to understand, control, and apply these cell membrane-modified lipid-DNA conjugates.     

A Review on Bioengineering Approaches to Insulin Delivery: A Pharmaceutical and Engineering Perspective

Diabetes mellitus (DM) is the most prevalent non‐contagious disease, which has affected a large number of people all over the world. Among all treatments known to have a positive influence in the control of DM, insulin therapy is the most common and effective one. Nowadays, various methods of insulin delivery are under investigation, which are able to reach a plausible bioavailability with ignorable side effects instead of insulin injection. This article presents a comprehensive review of the insulin therapy approach with a focus on modified methods in insulin delivery strategies and current advances in engineered insulin delivery systems.     

Dissipation of carbendazim and its metabolites in cucumber using liquid chromatography tandem mass spectrometry

Currently, there is growing interest in the degradation pathways of organic contaminants such as pesticides. In the case of pesticides, the determination of metabolites in agricultural products and environment is necessary as some of them could present similar toxicity to or even higher toxicity than the parent compound. The development of analytical methodology for the identification and quantification of carbendazim fungicide and its metabolites in cucumber was studied. Cucumber (cucumis sativus) is a global food in terms of economic importance and nutritional quality. Careful optimisation of the liquid chromatography–mass spectrometry (LC-MS)/MS parameters was achieved in order to attain a fast separation with the best sensitivity. The detection was carried out on an Ion-Trap tandem mass spectrometer (MS/MS) by electrospray ionisation in positive ion mode (ESI+) with multiple reaction monitoring (MRM).     

Production of light olefins from methanol over modified H-ZSM-5: effect of metal impregnation in high-silica zeolite on product distribution

Research on Chemical Intermediates - Improvement of H-ZSM-5 catalyst to convert methanol to light olefins was studied in this research. High-silica H-ZSM-5 zeolite (Si/Al = 200)...     

Preparation and characterization of Fe3O4@Cu-β-CD as a hybrid magnetic catalyst for the synthesis of dihydropyrano[2,3-c]pyrazoles in H2O

Research on Chemical Intermediates - Fe3O4@Cu-β-CD is a hybrid composite with high catalytic activity. Easy separation with an external magnet and recyclability are the advantages of this...     

Modification of Multiple Knot $B$-Spline Wavelet for Solving (Partially) Dirichlet Boundary Value Problem

A construction of multiple knot B-spline wavelets has been given in [C. K. Chui and E. Quak, Wavelet on a bounded interval, In: D. Braess and L. L. Schumaker, editors. Numerical methods of approximation theory. Basel: Birkhauser Verlag; (1992), pp. 57-76]. In this work, we first modify these wavelets to solve the elliptic (partially) Dirichlet boundary value problems by Galerkin and Petrov Galerkin methods. We generalize this construction to two dimensional case by Tensor product space. In addition, the solution of the system discretized by Galerkin method with modified multiple knot B-spline wavelets is discussed. We also consider a nonlinear partial differential equation for unsteady flows in an open channel called Saint-Venant. Since the solving of this problem by some methods such as finite difference and finite element produce unsuitable approximations specially in the ends of channel, it is solved by multiple knot B-spline wavelet method that yields a very well approximation. Finally, some numerical examples are given to support our theoretical results.     

Reaction of Chalcones with Cellular Thiols. The Effect of the 4-Substitution of Chalcones and Protonation State of the Thiols on the Addition Process. Diastereoselective Thiol Addition

Several biological effects of chalcones have been reported to be associated with their thiol reactivity. In vivo, the reactions can result in the formation of small-molecule or protein thiol adducts. Both types of reactions can play a role in the biological effects of this class of compounds. Progress of the reaction of 4-methyl- and 4-methoxychalcone with glutathione and N-acetylcysteine was studied by the HPLC-UV-VIS method. The reactions were conducted under three different pH conditions. HPLC-MS measurements confirmed the structure of the formed adducts. The chalcones reacted with both thiols under all incubation conditions. The initial rate and composition of the equilibrium mixtures depended on the ratio of the deprotonated form of the thiols. In the reaction of 4-methoxychalcone with N-acetylcysteine under strongly basic conditions, transformation of the kinetic adduct into the thermodynamically more stable one was observed. Addition of S-protonated N-acetylcysteine onto the polar double bonds of the chalcones showed different degrees of diastereoselectivity. Both chalcones showed a Michael-type addition reaction with the ionized and non-ionized forms of the investigated thiols. The initial reactivity of the chalcones and the equilibrium composition of the incubates showed a positive correlation with the degree of ionization of the thiols. Conversions showed systematic differences under each set of conditions. The observed differences can hint at the difference in reported biological actions of 4-methyl- and 4-methoxy-substituted chalcones.