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Journal of Solid State Electrochemistry - A stable suspension of nanopolyaniline (nPANI) particles can be used in various applications instead of a polyaniline film. The electrochemical behavior of...  相似文献   
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Russian Journal of Organic Chemistry - Herein, we report the sulfonamide-functionalized covalent organic framework (COF-SO3H), prepared by condensation of melamine and terephthalaldehyde and...  相似文献   
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A simple to use nuclear magnetic resonance analysis method has been tested on complex 1H, 19F, and 13C multiplets. This open-source line-shape analysis method analysis of total lineshape (ANATOLIA)1 provides some significant advantages over traditional assign-iterate methods of NMR spectral analysis by avoiding false minima and progressing optimisation to the global minimum. The target molecules are 1-perfluorotol-4-yl-2-perfluorotol-4-yl-oxymethyl-1H-benzimidazole (molecule-I) and 1-tetrafluoropyrid-4-yl-2-tetrafluoropyrid-4-yl-thio-1H-benzimidazole (molecule-II) which were produced as part of a family of fluorinated drug scaffolds prepared for anticancer and antiparasitic screening. Spectra display significant second-order effects with 1H Δδ = 3.68 and 4.67 Hz for the aromatic hydrogen “triplets”, with 19F 4JAA', 4JBB', 4JXX', and 4JYY' coupling constants range from +4.8 to −14.0 Hz and for 13C-isotopomers 19F Δδ of up to 111.56 Hz. A spin-system of six coupling nuclei (HaHbHcHd FYFY') was analysed in 12 s, a spin-system of nine coupling fluorine nuclei (AA'BB'CCC-YY') was analysed within 2 min, and 10 coupling nuclei (XX'YY'ZZZ-BB'-Hd) was optimised in 6 min using a laptop computer. ANATOLIA was also robust enough to be able to yield accurate spectral values from inaccurate input values. In both compounds, a fluorine–fluorine coupling constant was identified between the two fluoro-aromatic rings (FBB' and FYY') of +4.05 and +4.67 Hz and attributed to a through-space interaction. Ab initio structure optimisations and coupling constant calculations provided useful input data for spectral analysis. A modern 19F nuclear magnetic resonance spectrum of perfluorotoluene (octafluorotoluene) and analysis from 1975 was used as a test data set to assess ANATOLIA.  相似文献   
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This paper develops a mathematical model for project time compression problems in CPM/PERT type networks. It is noted this formulation of the problem will be an adequate approximation for solving the time compression problem with any continuous and non-increasing time-cost curve. The kind of this model is Mixed Integer Linear Program (MILP) with zero-one variables, and the Benders' decomposition procedure for analyzing this model has been developed. Then this paper proposes a new approach based on the surrogating method for solving these problems. In addition, the required computer programs have been prepared by the author to execute the algorithm. An illustrative example solved by the new algorithm, and two methods are compared by several numerical examples. Computational experience with these data shows the superiority of the new approach.  相似文献   
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This paper has two objectives. We introduce a new global optimization algorithm reformulating optimization problems in terms of boundary-value problems. Then, we apply this algorithm to a pointwise control problem of the viscous Burgers equation, where the control weight coefficient is progressively decreased. The results are compared with those obtained with a genetic algorithm and an LM-BFGS algorithm in order to check the efficiency of our method and the necessity of using global optimization techniques.  相似文献   
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Primary and secondary trimethylsilyl ethers were converted to their corresponding ethers in the presence Nafion-H® with good to excellent yields under mild and heterogeneous conditions.  相似文献   
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