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排序方式: 共有156条查询结果,搜索用时 15 毫秒
11.
Michael A. Bekos Michael Kaufmann Antonios Symvonis Alexander Wolff 《Computational Geometry》2007,36(3):215-236
We introduce boundary labeling, a new model for labeling point sites with large labels. According to the boundary-labeling model, labels are placed around an axis-parallel rectangle that contains the point sites, each label is connected to its corresponding site through a polygonal line called leader, and no two leaders intersect. Although boundary labeling is commonly used, e.g., for technical drawings and illustrations in medical atlases, this problem has not yet been studied in the literature. The problem is interesting in that it is a mixture of a label-placement and a graph-drawing problem.
In this paper we investigate several variants of the boundary-labeling problem. We consider labels of identical or different size, straight-line or rectilinear leaders, fixed or sliding ports for attaching leaders to sites and attaching labels to one, two or all four sides of the bounding rectangle. For any variant of the boundary labeling model, we aim at highly esthetical placements of labels and leaders. We present simple and efficient algorithms that minimize the total leader length or, in the case of rectilinear leaders, the total number of bends. 相似文献
12.
Although carbodiimides and succinimides are broadly employed for the formation of amide bonds (i.e., in amino acid coupling), their use in the coupling of peptides to water-soluble carboxylic-terminated colloidal gold nanoparticles remains challenging. In this article, we present an optimization study for the successful coupling of the KPQPRPLS peptide to spherical and rodlike colloidal gold nanoparticles. We show that the concentration, reaction time, and chemical environment are all critical to achieving the formation of robust, peptide-coated colloidal nanoparticles. Agarose gel electrophoresis was used for the characterization of conjugates. 相似文献
13.
C-H(ax)···Y(ax) contacts are a textbook prototype of steric hindrance in organic chemistry. The nature of these contacts is investigated in this work. MP2/6-31+G(d,p) calculations predicted the presence of improper hydrogen bonded C-H(ax)···Y(ax) contacts of different strength in substituted cyclohexane rings. To support the theoretical predictions with experimental evidence, several synthetic 2-substituted adamantane analogues (1-24) with suitable improper H-bonded C-H(ax)···Y(ax) contacts of different strength were used as models of a substituted cyclohexane ring. The (1)H NMR signal separation, Δδ(γ-CH(2)), within the cyclohexane ring γ-CH(2)s is raised when the MP2/6-31+G(d,p) calculated parameters, reflecting the strength of the H-bonded C-H(ax)···Y(ax) contact, are increased. In molecules with enhanced improper H-bonded contacts C-H(ax)···Y(ax), like those having sterically crowded contacts (Y(ax) = t-Bu) or contacts including considerable electrostatic attractions (Y(ax) = O-C or O═C) the calculated DFT steric energies of the γ-axial hydrogens are considerably reduced reflecting their electron cloud compression. The results suggest that the proton H(ax) electron cloud compression, caused by the C-H(ax)···Y(ax) contacts, and the resulting increase in Δδ(γ-CH(2)) value can be effected not just from van der Waals spheres compression, but more generally from electrostatic attraction forces and van der Waals repulsion, both of which are improper H-bonding components. 相似文献
14.
Fang J Kelarakis A Lin YW Kang CY Yang MH Cheng CL Wang Y Giannelis EP Tsai LD 《Physical chemistry chemical physics : PCCP》2011,13(32):14457-14461
We report a simple, scalable approach to improve the interfacial characteristics and, thereby, the performance of commonly used polyolefin based battery separators. The nanoparticle-coated separators are synthesized by first plasma treating the membrane in oxygen to create surface anchoring groups followed by immersion into a dispersion of positively charged SiO(2) nanoparticles. The process leads to nanoparticles electrostatically adsorbed not only onto the exterior of the surface but also inside the pores of the membrane. The thickness and depth of the coatings can be fine-tuned by controlling the ζ-potential of the nanoparticles. The membranes show improved wetting to common battery electrolytes such as propylene carbonate. Cells based on the nanoparticle-coated membranes are operable even in a simple mixture of EC/PC. In contrast, an identical cell based on the pristine, untreated membrane fails to be charged even after addition of a surfactant to improve electrolyte wetting. When evaluated in a Li-ion cell using an EC/PC/DEC/VC electrolyte mixture, the nanoparticle-coated separator retains 92% of its charge capacity after 100 cycles compared to 80 and 77% for the plasma only treated and pristine membrane, respectively. 相似文献
15.
Tan Sandra S. Y. Varvitsiotis Antonios Tan Vincent Y. F. 《Journal of Optimization Theory and Applications》2021,190(1):56-81
Journal of Optimization Theory and Applications - We introduce a new framework for unifying and systematizing the performance analysis of first-order black-box optimization algorithms for... 相似文献
16.
Goran Stegnjai Antonios D. Tsiailanis Milica Lazarevi Vasileios K. Gkalpinos Neda Djedovic Thomas Antoniou Suzana Stanisavljevi Mirjana Dimitrijevi Miljana Mom
ilovi ore Miljkovi Andreas G. Tzakos Bojan Jevti 《Molecules (Basel, Switzerland)》2022,27(24)
Gallic acid is a phenolic acid present in various plants, nuts, and fruits. It is well known for its anti-oxidative and anti-inflammatory properties. The phenethyl ester of gallic acid (PEGA) was synthesized with the aim of increasing the bioavailability of gallic acid, and thus its pharmacological potential. Here, the effects of PEGA on encephalitogenic cells were examined, and PEGA was found to modulate the inflammatory activities of T cells and macrophages/microglia. Specifically, PEGA reduced the release of interleukin (IL)-17 and interferon (IFN)-γ from T cells, as well as NO, and IL-6 from macrophages/microglia. Importantly, PEGA ameliorated experimental autoimmune encephalomyelitis, an animal model of chronic inflammatory disease of the central nervous system (CNS)—multiple sclerosis. Thus, PEGA is a potent anti-inflammatory compound with a perspective to be further explored in the context of CNS autoimmunity and other chronic inflammatory disorders. 相似文献
17.
M. N. Antonios 《Numerical Functional Analysis & Optimization》2013,34(11-12):1271-1307
In this paper, the use of optimal control theory to obtain optimal strategies for the control of aquatic models is illustrated. Several types of control variables are used including the rate of nutrient application and the rates of change of nutrient concentration in both the phytoplankton and zooplankton populations. Techniques are given to show how optimal control theory can be applied to several models with different states and control variables constraints. Explicit expressions and optimality conditions are given for singular controls whenever they exist. Some numerical techniques are suggested to couple the optimal control parts in the proper sequence. 相似文献
18.
Christina Tzitzoglaki Antonios Drakopoulos Athina Konstantinidi Ioannis Stylianakis Marianna Stampolaki Antonios Kolocouris 《Tetrahedron》2019,75(34):130408
Primary tert-alkyl amines include analogues of amantadine, a fragment commonly linked to pharmacophoric groups to enhance biological activity. The preparation of primary tert-alkyl amines is considered to be a difficult problem. Four synthetic procedures, some of which have been previously reported for the synthesis of amines with primary (RCH2NH2) or secondary (RR'CHNH2) alkyl and/or aryl groups, were tested for the synthesis of primary tert-alkyl amines (RR′R″CNH2) in aliphatic series including adamantane adducts. These procedures included the formation and reduction of tert-alkyl azides, the Ritter reaction in standard and modified conditions, the addition of organometallic reagents to N-tert-butyl sulfinyl ketimines and one-pot reactions between nitriles and organometallic reagents in the presence of a Lewis acid, Τi(iPrO)4 or CeCl3. These synthetic routes are unexplored for primary tert-alkyl amines. Studies on the synthetic routes for primary tert-alkyl amines are currently lacking. The reaction conditions and substrate limitations were studied for each procedure, with the first procedure being the most general and applicable also for compounds bearing bulky adducts. 相似文献
19.
We present a formalism for calculating the absorption coefficient of a pair of coaxial tubules. A spatially nonlocal, dynamical self-consistent field theory is obtained by calculating the electrostatic potential produced by the charge density fluctuations as well as the external electric field. There are peaks in the absorption spectrum arising from plasma excitations corresponding either to plasmon or particle-hole modes. In this Letter, we numerically calculate the plasmon contribution to the absorption spectrum when an external electric field is applied. The number of peaks depends on the radius of the inner as well as outer tubule. The height of each peak is determined by the plasmon wavelength and energy. For a chosen wave number, the most energetic plasmon has the highest peak corresponding to the largest oscillator strength of the excited modes. Some of the low-frequency plasmon modes have such weak coupling to an external electric field that they are not seen on the same scale as the modes with larger energy of excitation. We plot the peak positions of the plasmon excitations for a pair of coaxial tubules. The coupled modes on the two tubules are split by the Coulomb interaction. The energies of the two highest plasmon branches increase with the radius of the outer tubule. On the contrary, the lowest modes decrease in energy as this radius is increased. No effects due to inter-tubule hopping are included in these calculations. 相似文献
20.