Synthesis and pharmacological properties of polysubstituted 2-amino-4H-pyran-3-carbonitrile derivatives

Molecular Diversity - 2-Amino-3-cyano-4H-chromenes are structural core motifs that received increasing attention in the last years due to their interesting potential pharmacological properties. In...     

Graphene to graphite; a layer by layer experimental measurements and density function theory calculations of electric conductivity

ABSTRACT

We measured the electric conductivity of large (25?×?50?mm) graphene films as a function of number of layers in the range of 1–20 layers. We also calculated the energy gap for such samples using density function theory. Our results showed a conductivity slightly above that of ITO for monolayer graphene and an exponential decrease as the number of graphene layers increased. Both experimental and simulation results showed a convergence of graphene into graphite at as little as 18–20 layers.     

Pion-proton elastic scattering at 200 GeV/c

Recent measurements of differential and elastic cross-sections, slope parameters and ratios of the real and imaginary parts of the forward scattering amplitudes for pion-proton elastic scattering at 200 GeV/c have been fitted by using a simple Regge pole model with phenomenological residue functions. The computed results for total cross-sections have also been compared with the experimental data.     

Optimal control theory of an age-structured coronavirus disease model and the dynamical analysis of the underlying ordinary differential equation model having constant parameters

This paper addresses the dynamics of COVID-19 using the approach of age-structured modeling. A particular case of the model is presented by taking into account age-free parameters. The sub-model consisting of ordinary differential equations (ODEs) is investigated for possible equilibria, and qualitative aspects of the model are rigorously presented. In order to control the spread of the disease, we considered two age- and time-dependent non-pharmaceutical control measures in the age-structured model, and an optimal control problem using a general maximum principle of Pontryagin type is achieved. Finally, sample simulations are plotted which support our theoretical work.     

Hartree-Fock energies of D and D doubly excited states of the lithium isoelectronic sequence

Hartree-Fock energies of 1s2snd ⁴D, 1s2pnp ⁴D and 1s2pnd ⁴D⁰, n=3–5 of lithium isoelectronic sequence from Li to Ne⁺⁷ are reported. These results in conjunction with the energy of the lowest ⁴P and ⁴P⁰ states of the lithium isoelectronic sequence as calculated by Holoien and Geltman, are used to check some proposed assignments of lines obtained in beamfoil spectroscopy of Be(II), C(IV) and N(V).     

Hawking Absorption and Planck Absolute Entropy of Kerr-Newman Black Hole

We find the existence of a quantum thermal effect, “Hawking absorption.” near the inner horizon of the Kerr–Newman black hole. Redefining the entropy, temperature, angular velocity, and electric potential of the black hole, we give a new formulation of the Bekenstein–Smarr formula. The redefined entropy vanishes for absolute zero temperature of the black hole and hence it is interpreted as the Planck absolute entropy of the KN black hole.     

Waveguide electro-optic modulator in fused silica fabricated by femtosecond laser direct writing and thermal poling

An integrated electro-optic waveguide modulator is demonstrated in bulk fused silica. A Mach-Zehnder interferometer waveguide structure is fabricated by direct writing with a femtosecond laser followed by thermal poling. A 20 degrees electro-optic phase shift is achieved at an operating wavelength of 1.55 microm with an applied voltage of 400 V and an interaction length of 25.6 mm, which correspond to an estimated effective electro-optic coefficient of 0.17 pm/V for the TE-polarized mode.     

Anti-proliferative effects of gold nanoparticles functionalized with Semaphorin 3F

The new vessel formations play a vital role in growth and spread of cancer. Current anti-angiogenic therapies, predominantly based on vascular endothelial growth factor (VEGF) inhibition, can inhibit vascular development; however, they are usually ineffective against the primary tumor occurrence. The aim of this study was to assess anti-angiogenic effects of gold nanoparticles (AuNPs) functionalized with Semaphorin (Sema) 3F protein. The polyethylene glycol (PEG)-coated AuNPs were covalently functionalized with Sema 3F and labeled with the TAMRA fluorescent dye. The effect of the NPs on human umbilical vein endothelial cells (HUVECs) is probed in the way of internalization and viability assays. AuNP-Sema 3F bioconjugates showed great endothelial cell uptake. AuNP-Sema 3F bioconjugates reduced VEGF₁₆₅-induced endothelial cell proliferation more effectively than Sema 3F alone, suggesting that the therapeutic effects of Sema 3F can be improved by conjugation to AuNPs. Also, no significant toxicity effect was induced by bioconjugates. This is the first study that reports a covalent binding of full length Sema 3F to NPs. The exogenously administration of Sema 3F, which has both anti-angiogenic and anti-tumoral activity, to tumor vasculature via a carrying platform may not only lead to more effective anti-angiogenic treatment but also may make current approach more applicable in clinical use like drug delivery system.

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Graphical abstract Anti-proliferative effects of gold nanoparticles conjugated with Semaphorin 3F against VEGF₁₆₅-stimulated cell proliferation

     

Phase transition and thermodynamic stability in extended phase space and charged Hořava–Lifshitz black holes

For charged black holes in Ho?ava–Lifshitz gravity, a second order phase transition takes place in extended phase space where the cosmological constant is taken as thermodynamic pressure. We relate the second order nature of phase transition to the fact that the phase transition occurs at a sharp temperature and not over a temperature interval. Once we know the continuity of the first derivatives of the Gibbs free energy, we show that all the Ehrenfest equations are readily satisfied. We study the effect of the perturbation of the cosmological constant as well as the perturbation of the electric charge on thermodynamic stability of Ho?ava–Lifshitz black hole. We also use thermodynamic geometry to study phase transition in extended phase space. We investigate the behavior of scalar curvature of Weinhold, Ruppeiner, and Quevedo metric in extended phase space of charged Ho?ava–Lifshitz black holes. It is checked if these curvatures could reproduce the result of specific heat for the phase transition.