Regio- and Z-Selective Alkyne Hydroamination and Hydrophenoxylation using Tetrafluoro-λ6-Sulfanyl Alkynes under Superbasic,Naked Anion Conditions

Alkyne hydroamination is an effective approach for the production of enamines and enamine-containing N-heterocycles. However, stereoselectivity control is a considerable challenge in this reaction because of the electronic repulsion between an incoming nitrogen lone pair and the alkyne π-system. Herein, we propose a methodology involving β-regio- and Z-selective alkyne hydroamination by using tetrafluoro-λ⁶-sulfanyl (SF₄) alkynes under superbasic, naked anion conditions. The reaction is compatible with a wide variety of N-heterocycles, including indoles, carbazoles, pyrazoles, and imidazoles, and selectively furnishes SF₄-linked Z-vinyl enamines with β-regioselectively. Moreover, the method can be extended to the β- and Z-controlled, base-mediated alkyne hydrophenoxylation with phenols to provide SF₄-linked Z-vinyl ethers in high yields. As the SF₄ unit has attracted attention as a bioisostere for alkynes, p-benzenes, bicyclo[1.1.1]pentyl (BCP) groups, and cubanes in medicinal chemistry, this chemistry represents an effective approach to creating novel drug candidates incorporating SF₄-containing molecules.     

A Necessary and Sufficient Condition for the Existence of a Heterochromatic Spanning Tree in a Graph

We prove the following theorem. An edge-colored (not necessary to be proper) connected graph G of order n has a heterochromatic spanning tree if and only if for any r colors (1≤r≤n−2), the removal of all the edges colored with these r colors from G results in a graph having at most r+1 components, where a heterochromatic spanning tree is a spanning tree whose edges have distinct colors.     

On Calabi’s Strong Maximum Principle via Local Semi-Dirichlet Forms

We give a stochastic proof of an extension of E. Calabi??s strong maximum principle under some geometric conditions in the framework of strong Feller diffusion processes associated to local regular semi-Dirichlet forms with lower bounds. As a corollary, our notion of subharmonicity implies a notion of viscosity subsolution in a stochastic sense. We can apply our result to singular geometric object like Alexandrov space, limit space under spectral distance of Riemannian manifolds with uniform lower Ricci curvature bound and so on.     

Singular sets for curvature equation of order k

We consider the removability of singular sets for the curvature equations of the form Hk[u]=ψ, which is determined by the kth elementary symmetric function, in an n-dimensional domain Ω. We prove that, for 1?k?n−1 and a compact set K whose (n−k)-dimensional Hausdorff measure is zero, any generalized solution to the curvature equation on Ω?K is always extendable to a generalized solution on the whole domain Ω.     

On the efficient application of weighted essentially nonoscillatory scheme

In this paper, the efficient application of high‐order weighted essentially nonoscillatory (WENO) reconstruction to the subsonic and transonic engineering problems is studied. On the basis of the physical considerations, two techniques are proposed to enhance the accuracy and efficiency of the WENO reconstruction. First, it is observed that the WENO scheme using characteristic variable has better accuracy and convergence speed than the scheme using primitive variable. For engineering problems with shock of moderate amplitude, on the basis of the Rankine–Hugoniot conditions, a simplified characteristic‐variable‐based WENO is developed. The simplified version significantly reduces the cost overhead without sacrificing the shock‐capturing capability. Second, in this work, it is found for viscous case that it is better to include the viscous effect. On the basis of a simple analysis, the viscous correction to the parameter ε in the WENO reconstruction is proposed. Numerical results indicate, with the proposed simplified characteristic‐variable‐based reconstruction and the viscous correction, that the nonlinear WENO interpolation is sharply activated in the region of shock jump, whereas in the shockless area, the WENO interpolation weights are tuned towards the designed optimal value for better accuracy. Compared with the original characteristic‐variable‐based WENO, the current implementation has similar accuracy and reduced cost. At the same time, compared with the primitive variable‐based WENO, better accuracy and convergence speed are obtained at marginal cost overhead. Several practical cases are calculated to demonstrate the accuracy and efficiency of the current methodology. Copyright © 2012 John Wiley & Sons, Ltd.     

Analysis of a meshless solver for high Reynolds number flow

In this paper, the extension of an upwind least‐square based meshless solver to high Reynolds number flow is explored, and the properties of the meshless solver are analyzed both theoretically and numerically. Existing works have verified the meshless solver mostly with inviscid flows and low Reynolds number flows, and in this work, we are interested in the behavior of the meshless solver for high Reynolds number flow, especially in the near‐wall region. With both theoretical and numerical analysis, the effects of two parameters on the meshless solver are identified. The first one is the misalignment effect caused by the significantly skewed supporting points, and it is found that the meshless solver still yields accurate prediction. It is a very interesting property and is opposite to the median‐dual control volume based vertex‐centered finite volume method, which is known to give degraded result with stretched triangular/tetrahedral cells in the near‐wall region. The second parameter is the curvature, and according to theoretical analysis, it is found in the region with both large aspect ratio and curvature, and the streamwise residual is less affected; however, the wall‐normal counterpart suffers from accuracy degradation. In this paper, an improved method that uses a meshless solver for the streamwise residual and finite difference for wall‐normal residual is developed. This method is proved to be less sensitive to the curvature and provides improved accuracy. This work presents an understanding of the meshless solver for high Reynolds number flow computation, and the analysis in this paper is verified with a series of numerical experiments. Copyright © 2012 John Wiley & Sons, Ltd.     

The surjectivity of the canonical homomorphism from singular homology to Cech homology

Let be a locally -connected compact metric space. Then, the canonical homomorphism from the singular homology group to the Cech homology group is surjective. Consequently, if a compact metric space is locally connected, then the canonical homomorphism from to is surjective.

     

Crosscap numbers of pretzel knots

The crosscap number of a knot in the 3-sphere is defined as the minimal first Betti number of non-orientable surfaces bounded by the knot. In this paper, we determine the crosscap numbers of a large class of pretzel knots. The key ingredient to obtain the result is the algorithm of enumerating all essential surfaces for Montesinos knots developed by Hatcher and Oertel.