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81.
In this work we employed UV resonance Raman spectroscopy with 229 nm excitation to study two tryptophan‐containing antimicrobial peptides with a broad‐spectrum activity against Gram‐positive and Gram‐negative bacteria: lactoferricin B (LfB, RRWQWRMKKLG) and pEM‐2 (KKWRWWLKALAKK). UV resonance Raman spectra of both peptides are dominated by tryptophan bands. Raman spectra of LfB and pEM‐2 in D2O and 2,2,2‐trifluoro ethanol (TFE) have been measured and used to identify the hydrogen‐bond strength marker bands W6 and W17. The tryptophan doublet, W7, at 1340 and 1360 cm−1 was used to detect an increase in the hydrophobicity of Trp environment in TFE. The spectra of LfB in complex with model cell membranes composed of zwitterionic dipalmitoylglycero‐phosphocholine (DPPC) or anionic dipalmitoyglycero‐phosphoglycerol (DPPG) lipid vesicles revealed a more hydrophobic Trp environment in DPPG, suggesting stronger interactions between the cationic peptide and anionic model cell membrane. Copyright © 2008 John Wiley & Sons, Ltd. 相似文献
82.
Adrien Savoyant Anne‐Marie Dar Roland Hayn Roman Kuzian Anatoli Stepanov 《physica status solidi b》2010,247(7):1691-1694
The single ion magnetic anisotropy of S‐state transition metal ions (3d5) in wurtzite diluted magnetic semiconductors (DMS) is studied from a microscopic point of view. Starting from a hamiltonian including Coulomb, spin–orbit and effective crystal field interactions, the axial spin hamiltonian parameter is calculated by using an exact diagonalization method. Application to some Mn‐doped DMS validates the model. 相似文献
83.
The radiative response of the classical electron is commonly described by the Lorentz–Abraham–Dirac (LAD) equation. Dirac’s derivation of this equation is based on energy and momentum conservation laws and on regularization of the field singularities and infinite energies of the point charge by subtraction of certain quantities: “We... shall try to get over difficulties associated with the infinite energy of the process by a process of direct omission or subtraction of unwanted terms”. To substantiate Dirac’s approach and clarify the mass renormalization, we introduce the point charge as a limit of extended charges contracting to a point; the fulfillment of conservation laws follows from the relativistic covariant Lagrangian formulation of the problem. We derive the relativistic point charge dynamics described by the LAD equation from the extended charge dynamics in a localization limit by a method which can be viewed as a refinement of Dirac’s approach in the spirit of Ehrenfest theorem. The model exhibits the mass renormalization as the cancellation of Coulomb energy with the Poincaré cohesive energy. The value of the renormalized mass is not postulated as an arbitrary constant, but is explicitly calculated. The analysis demonstrates that the local energy–momentum conservation laws yield dynamics of a point charge which involves three constants: mass, charge and radiative response coefficient θ. The value of θ depends on the composition of the adjacent potential which generates Poincaré forces. The classical value of the radiative response coefficient is singled out by the global requirement that the adjacent potential does not affect the radiated energy balance and affects only the local energy balance involved in the renormalization. 相似文献
84.
Polina Vinogradova Anatoli Zarubin 《Numerical Functional Analysis & Optimization》2013,34(1-2):148-167
In the current paper, we study a projection method for a Cauchy problem for an operator-differential equation with a leading self-adjoint operator A(t) and a subordinate linear operator K(t) in a Hilbert space. The projection subspaces are linear spans of eigenvectors of an operator similar to A(t). It is assumed that the operators A(t) and K(t) are sufficiently smooth. Error estimates for the approximate solutions and their derivatives are obtained. The application of the developed method for solving the initial boundary value problems is given. 相似文献
85.
86.
Eriks Klotins Anatoli I. Popov Vladimir Pankratov Liana Shirmane Davis Engers 《Central European Journal of Physics》2011,9(2):438-445
We report construction of a model of polar nanoregions in the PMN relaxor ferroelectric based on first-principles lattice
dynamics for chemically ordered supercells [S.A. Prosandeev et al., Phys. Rev. B 70, 134110 (2004)], combined with invariance
under permutations and dipole-dipole interaction as a source supporting randomly oriented residual polarization. Representative
analytical estimates of polar nanore-gion — supercell mapping reproduce both nonzero local and zero macroscopic polarization
of the structure, as well as the temperature change of the supercell anisotropy at cooling and field cooling. 相似文献
87.
Potential Analysis - We consider the Cauchy problem for the evolutive discrete p-Laplacian in infinite graphs, with initial data decaying at infinity. We prove optimal sup and gradient bounds for... 相似文献
88.
Anatoli Torokhti Phil Howlett Charles Pearce 《Journal of Computational Analysis and Applications》2003,5(3):299-312
We present a new approach to the approximation of nonlinear operators in probability spaces. The approach is based on a combination of the specific iterative procedure and the best approximation problem solution with a quadratic approximant. We show that the combination of these new techniques allow us to build a computationally efficient and flexible method. The algorithm of the method and its application to the optimal filtering of stochastic signals are given. 相似文献
89.
We propose a new approach which generalizes and improves principal component analysis (PCA) and its recent advances. The approach is based on the following underlying ideas. PCA can be reformulated as a technique which provides the best linear estimator of the fixed rank for random vectors. By the proposed method, the vector estimate is presented in a special quadratic form aimed to improve the error of estimation compared with customary linear estimates. The vector is first pre-estimated from the special iterative procedure such that each iterative loop consists of a solution of the unconstrained nonlinear best approximation problem. Then, the final vector estimate is obtained from a solution of the constrained best approximation problem with the quadratic approximant. We show that the combination of these techniques allows us to provide a new nonlinear estimator with a significantly better performance compared with that of PCA and its known modifications. 相似文献
90.
Anatoli E. Merzon Jose E. De la Paz Méndez 《Mathematical Methods in the Applied Sciences》2011,34(15):1843-1872
We continue our study of a nonstationary scattering by wedges. In this paper we consider nonstationary scattering of plane waves by a ‘hard–soft’ wedge. We prove the uniqueness and existence of a solution to the corresponding DN‐Cauchy problem in appropriate functional spaces. We also give the explicit form of the solution and prove the Limiting Amplitude Principle. Copyright © 2011 John Wiley & Sons, Ltd. 相似文献