Words that almost commute

The Hamming distance $\mathrm{ham}(u,v)$ between two equal-length words u, v is the number of positions where u and v differ. The words u and v are said to be conjugates if there exist non-empty words $x,y$ such that $u=xy$ and $v=yx$. The smallest value $\mathrm{ham}(xy,yx)$ can take on is 0, when x and y commute. But, interestingly, the next smallest value $\mathrm{ham}(xy,yx)$ can take on is 2 and not 1. In this paper, we consider conjugates $u=xy$ and $v=yx$ where $\mathrm{ham}(xy,yx)=2$. More specifically, we provide an efficient formula to count the number $h(n)$ of length-n words $u=xy$ over a k-letter alphabet that have a conjugate $v=yx$ such that $\mathrm{ham}(xy,yx)=2$. We also provide efficient formulae for other quantities closely related to $h(n)$. Finally, we show that $h(n)$ grows erratically: cubically for n prime, but exponentially for n even.     

以gp41为靶标的小分子-多肽缀合物作为HIV-1融合抑制剂的设计、合成及活性初筛

芳基吡咯类小分子化合物NB-2衍生物(Noc或Npc)与衍生于C34中的靶标特异性多肽P26所形成的缀合物具有低纳摩尔水平的融合抑制活性.本文通过不同长度或不同柔性的连接臂将Noc或Npc与衍生于C34的靶标特异性多肽P27缀合,探讨了C34中a位残基I635和连接臂对缀合物活性的影响.人体免疫缺陷病毒1型(HIV-1)Env介导的细胞-细胞融合实验结果表明,多肽与小分子之间产生了强的协同作用.     

The Gauss-Newton Methods via Conjugate Gradient Path without Line Search Technique for Solving Nonlinear Systems

In this article, we propose the Gauss-Newton methods via conjugate gradient path for solving nonlinear systems. By constructing and solving a linearized model of the nonlinear systems, we obtain the iterative direction by employing the conjugate gradient path. In successive iterations, the approximate Jacobian of the nonlinear systems is updated by a Broyden formula to construct the conjugate path. The global convergence and local superlinear convergence rate of the proposed algorithms are established under some reasonable conditions. Finally, the numerical results are reported to show the effectiveness of the proposed algorithms.     

Bifunctional Iminophosphorane-Catalyzed Enantioselective Nitroalkane Addition to Unactivated α,β-Unsaturated Esters**

Herein we describe the enantioselective intermolecular conjugate addition of nitroalkanes to unactivated α,β-unsaturated esters, catalyzed by a bifunctional iminophosphorane (BIMP) superbase. The transformation provides the most direct access to pharmaceutically relevant enantioenriched γ-nitroesters, utilizing feedstock chemicals, with unprecedented selectivity. The methodology exhibits a broad substrate scope, including β-(fluoro)alkyl, aryl and heteroaryl substituted electrophiles, and was successfully applied on a gram scale with reduced catalyst loading, and, additionally, catalyst recovery was carried out. The formal synthesis of a range of drug molecules, and an enantioselective synthesis of (S)-rolipram were achieved. Additionally, computational studies revealed key reaction intermediates and transition state structures, and provided rationale for high enantioselectivities, in good agreement with experimental results.     

Stereodivergent Construction of 1,3-Chiral Centers via Tandem Asymmetric Conjugate Addition and Allylic Substitution Reaction

Herein, we report a synthesis of cyclohexanones bearing multi-continuous stereocenters by combining copper-catalyzed asymmetric conjugate addition of dialkylzinc reagents to cyclic enones with iridium-catalyzed asymmetric allylic substitution reaction. Good to excellent yields, diastereoselectivity and enantioselectivity can be obtained. Unlike the stereodivergent construction of adjacent stereocenters (1,2-position) reported in the literature, the current reaction can achieve the stereodivergent construction of nonadjacent stereocenters (1,3-position) by a proper combination of two chiral catalysts with different enantiomers.     

供/吸电子基团共轭桥联的双BODIPY衍生物的合成及性能

设计合成了4种对称的以不同供/吸电子基团为共轭桥、两端连接meso位苯或噻吩取代的新型氟化硼二吡咯甲川(BODIPY)衍生物;通过1H NMR,13C NMR和MS等手段对其进行了结构表征;并采用紫外吸收光谱、荧光发射光谱及循环伏安(CV)等方法研究了其光电性能.紫外光谱数据表明,BODIPY结构具有明显的特征吸收,中间的桥联基团无论是强供电子的苯并二噻吩(BDT)还是强吸电子的苯并噻二唑(BT)均不能使整个分子产生明显的分子内电子迁移(ICT).另一方面,meso位的取代基可与BODIPY核产生微弱的ICT,且meso位噻吩取代的分子比meso位苯环取代的分子表现出更强的ICT.紫外光谱数据和电化学测试结果表明,meso位噻吩取代的分子比meso位苯环取代的分子具有更低的氧化电位和更窄的能隙.     

Graph theoretical duality perspective on conjugate structures and its applications

The paper shows that representing structures, beams and frames by mathematical models based on graph theory enables to provide new perspective on known conjugate structure theorems in mechanics. It is shown that the latter theorems can be derived from the graph theoretical duality principle applied upon the graph representations of the structures. The results reported indicate upon theoretical value of the approach, as the established mathematical foundation can be employed in a variety of mechanical disciplines.     

Un nouveau préconditionneur pour les problèmes elliptiques à coefficients variablesA new preconditonner for general elleptic problems

In this Note we describe a preconditionner for iteratively solving the linear system arising from the discretization of a general nonseparable elliptic problem by spectral element method. This preconditionner is constructed from approximating the original problem with the closest (in some sense) separable elliptic problem. A direct method is then used to invert the preconditionner. To cite this article: M. Azaïez et al., C. R. Mecanique 331 (2003).