排序方式: 共有39条查询结果,搜索用时 125 毫秒
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Cristina Bucur Mihaela Badea Mariana Carmen Chifiriuc Coralia Bleotu Emilia Elena Iorgulescu Irinel Adriana Badea Maria Nicoleta Grecu Veronica Lazăr Oana-Irina Patriciu Dana Marinescu Rodica Olar 《Journal of Thermal Analysis and Calorimetry》2014,115(3):2179-2189
Novel complexes of M2LCl4·nH2O type (M:Ni, n = 4; M:Cu, n = 3 and M:Zn, n = 0; L: ligand resulted from 1,4-phenylenediamine, 3,6-diazaoctane-1,8-diamine and formaldehyde one-pot condensation) were synthesized and characterised by microanalytical, ESI–MS, IR, UV–Vis, 1H NMR and EPR spectra, magnetic data at room temperature and molar conductivities as well. The electrochemical behaviour of complexes was investigated by cyclic voltammetry. Simultaneous TG/DTA measurements were performed in order to evidence the thermal behaviour of the obtained complexes. Processes such as water elimination, fragmentation and oxidative degradation of the organic ligand as well as chloride elimination occurred during thermal decomposition. The antimicrobial assays demonstrate that the compounds exhibited good antibacterial activity, especially against S. aureus and E. coli strains, the most active being the copper(II) complex, which also exhibited the most prominent anti-biofilm effect, suggesting its potential use for the development of new antimicrobial agents. The biological activity was correlated with log P ow values. All complexes disrupt the membrane integrity of HCT 8 tumour cells. 相似文献
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Mihaela Badea Larisa Calu Mariana Carmen Chifiriuc Coralia Bleotu Alexandra Marin Sebastian Ion Gabriela Ioniţă Nicolae Stanică Luminiţa Măruţescu Veronica Lazăr Dana Marinescu Rodica Olar 《Journal of Thermal Analysis and Calorimetry》2014,118(2):1145-1157
A series of complexes of type [ML(CH3COO)(OH2)2] (M: Co, Ni; HL: 2-[(E)-1H-1,2,4-triazol-3-ylimino)methyl]phenol)) and [M2L2(CH3COO)2(OH2)n] (M: Cu, n = 2; M: Zn, n = 0) were synthesised by template condensation. The compounds were characterised with microanalytical, ESI–MS, IR, electronic, EPR spectra and magnetic data at room temperature. Based on the IR and ESI–MS spectra, a dinuclear structure with the acetate as bridge was proposed for Cu(II) and Zn(II) complexes. The dinuclear structure of Cu(II) complex is also consistent with both magnetic behaviour and EPR spectrum. The thermal analyses have evidenced processes as water elimination, acetate decomposition, as well as oxidative degradation of the Schiff base. The final decomposition product was the most stable metal oxide as indicated by powder X-ray diffraction. The cobalt and copper compounds exhibited a broad spectrum of antibacterial activity towards both planktonic and biofilm-embedded cells. The complexes exhibit a low cytotoxicity except for Cu(II) species that induces the early apoptosis for the HEp 2 cells. 相似文献
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The complexity of finding $\epsilon $ -approximate first-order critical points for the general smooth constrained optimization problem is shown to be no worse that $O(\epsilon ^{-2})$ in terms of function and constraints evaluations. This result is obtained by analyzing the worst-case behaviour of a first-order short-step homotopy algorithm consisting of a feasibility phase followed by an optimization phase, and requires minimal assumptions on the objective function. Since a bound of the same order is known to be valid for the unconstrained case, this leads to the conclusion that the presence of possibly nonlinear/nonconvex inequality/equality constraints is irrelevant for this bound to apply. 相似文献
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Mathematical Programming - We introduce a general framework for large-scale model-based derivative-free optimization based on iterative minimization within random subspaces. We present a... 相似文献
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An Adaptive Regularisation algorithm using Cubics (ARC) is proposed for unconstrained optimization, generalizing at the same
time an unpublished method due to Griewank (Technical Report NA/12, 1981, DAMTP, University of Cambridge), an algorithm by
Nesterov and Polyak (Math Program 108(1):177–205, 2006) and a proposal by Weiser et al. (Optim Methods Softw 22(3):413–431,
2007). At each iteration of our approach, an approximate global minimizer of a local cubic regularisation of the objective
function is determined, and this ensures a significant improvement in the objective so long as the Hessian of the objective
is locally Lipschitz continuous. The new method uses an adaptive estimation of the local Lipschitz constant and approximations
to the global model-minimizer which remain computationally-viable even for large-scale problems. We show that the excellent
global and local convergence properties obtained by Nesterov and Polyak are retained, and sometimes extended to a wider class
of problems, by our ARC approach. Preliminary numerical experiments with small-scale test problems from the CUTEr set show encouraging performance of the ARC algorithm when compared to a basic trust-region implementation. 相似文献
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Coralia Cartis Nick I. M. Gould Philippe L. Toint 《Foundations of Computational Mathematics》2018,18(5):1073-1107
High-order optimality conditions for convexly constrained nonlinear optimization problems are analysed. A corresponding (expensive) measure of criticality for arbitrary order is proposed and extended to define high-order \(\epsilon \)-approximate critical points. This new measure is then used within a conceptual trust-region algorithm to show that if derivatives of the objective function up to order \(q \ge 1\) can be evaluated and are Lipschitz continuous, then this algorithm applied to the convexly constrained problem needs at most \(O(\epsilon ^{-(q+1)})\) evaluations of f and its derivatives to compute an \(\epsilon \)-approximate qth-order critical point. This provides the first evaluation complexity result for critical points of arbitrary order in nonlinear optimization. An example is discussed, showing that the obtained evaluation complexity bounds are essentially sharp. 相似文献
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Zarafu Irina Badea Mihaela Ioniţă Gabriela Chifiriuc Mariana Carmen Bleotu Coralia Popa Marcela Ioniţă Petre Tatibouët Arnaud Olar Rodica 《Journal of Thermal Analysis and Calorimetry》2019,136(5):1977-1987
Journal of Thermal Analysis and Calorimetry - A series of complexes [Cu(L)(CH3COO)2]·nH2O (L: isonicotinic acid 2-(2-hydroxy-8-substituted-tricyclo[7.3.1.02.7]tridec-13-ylidene)-hydrazones)... 相似文献
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Calu Larisa Badea Mihaela Čelan Korošin Nataša Chifiriuc Mariana Carmen Bleotu Coralia Stanică Nicolae Silvestro Luigi Maurer Martin Olar Rodica 《Journal of Thermal Analysis and Calorimetry》2018,134(3):1839-1850
Journal of Thermal Analysis and Calorimetry - A novel series of complexes ML(ClO4)·nH2O (M: Co, Ni, Cu, Zn; HL: 2-[(E)-(1H-1,2,4-triazol-3-ylimino)methyl]phenol) have been synthesized and... 相似文献
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Zarafu Irina Olar Rodica Chifiriuc Mariana Carmen Bleotu Coralia Ioniţă Petre Mulţescu Mihaela Ioniţă Gabriela Grădişteanu Graţiela Tatibouët Arnaud Badea Mihaela 《Journal of Thermal Analysis and Calorimetry》2018,134(3):1851-1861
Journal of Thermal Analysis and Calorimetry - A series of Schiff bases resulted in the [1?+?1] condensation of 8-alkyl-2-hydroxy-tricyclo[7.3.1.02.7]-tridecan-13-one with the... 相似文献