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991.
Alpeshkumar K. Malde Santosh A. Khedkar Evans C. Coutinho 《Journal of Physical Organic Chemistry》2007,20(2):151-160
Modification of peptides to produce peptidomimetics is of great interest, with the aim of designing potent, selective, and metabolically stable analogs having certain conformational properties. Organoboranes have been reported in the literature with a wide range of therapeutic applications. One of the therapeutically important class of molecules is amine‐carboxyboranes derived from amino acids by replacement of the Cα atom of an amino acid/peptide by boron. The conformational preferences of these peptides, with respect to backbone ω, ?, and ψ torsion angles, have been investigated by theoretical calculations. The amide bond in these molecules has the same geometry in the ground and transition states as the natural peptides. However, the boron isosteres of glycine and alanine peptides are less structured than their natural derivatives, but are distinguished by structures with a positive value for the ? angle, which is normally disfavored for natural peptides. This property could be used to build peptides with a geometry not usually seen in natural peptides. Copyright © 2007 John Wiley & Sons, Ltd. 相似文献
992.
P.V.V. Jayaweera P.K.D.D.P. Pitigala M.K.I. Seneviratne A.G.U. Perera K. Tennakone 《Infrared Physics & Technology》2007,50(2-3):270-273
All electronic devices are plagued with 1/f noise originating from many causes. The most important factors contributing to 1/f noise in a semiconductor is believed to be recombination of carriers and their trapping at defects and impurity sites. Adsorption of moisture and electron acceptor molecules enhances the intensity of 1/f noise. Amazingly, some molecular species that strongly chelate to the semiconductor surface, suppress 1/f noise owing to passivation of the recombination sites. Thus in addition to sensitization, the dye adsorbed on the nanocrystallites plays a key role in mitigation of recombinations. For this reason dye-sensitized heterojunctions could also find application as low noise NIR photon detectors. Experiments conducted with oxide semiconductors (TiO2, ZnO, SnO2) indicate that the mode of binding of dyes at specific sites determines the extent to which the recombination and 1/f noise are suppressed. The transport of electrons in a nanocrystalline matrix is diffusive with a diffusion coefficient D depending on the trapping and detrapping processes. Thus passivation of trapping sites by the adsorbed dye is expected to increase the response time which can be expressed as τ L2/D, where L = thickness of the nanocrystalline film. Measurement techniques and construction of a dye-sensitized NIR photon detector will be discussed. 相似文献
993.
We investigate the Scheme programming language opportunities to analytically calculate the Clebsch-Gordan coefficients, Wigner
6j and 9j symbols, and general recoupling coefficients that are used in the quantum theory of angular momentum. The considered coefficients
are calculated by a direct evaluation of the sum formulas. The calculation results for large values of quantum angular momenta
were compared with analogous calculations with FORTRAN and Java programming languages.
The text was submitted by the authors in English. 相似文献
994.
So-Yon Lim Matt Meyer Richard A Kjonaas Swapan K Ghosh 《Journal of immune based therapies and vaccines》2007,5(1):3-1
This is a correction article. 相似文献
995.
E. de A. Gonçalves V. M. de Oliveira A. Rosas P. R.A. Campos 《The European Physical Journal B - Condensed Matter and Complex Systems》2007,59(1):127-132
Adaptation of populations takes place with the occurrence and subsequent fixation of mutations that confer some selective
advantage
to the individuals which acquire it. For this reason, the study of the process of fixation of advantageous mutations has a
long history
in the population genetics literature. Particularly, the previous investigations aimed to find out the main evolutionary forces
affecting the strength of natural selection in the populations.
In the current work, we investigate the dynamics of fixation of beneficial mutations in a subdivided population. The subpopulations
(demes)
can exchange migrants
among their neighbors, in a migration network which is assumed to have either a random graph or a scale-free topology. We
have observed that the migration rate
drastically affects the dynamics of mutation fixation, despite of the fact that the probability of fixation is invariant on
the
migration rate, accordingly to
Maruyama's conjecture. In addition, we have noticed a topological dependence of the adaptive evolution of the population when
clonal interference
becomes effective. 相似文献
996.
In experiment PAX, proposed for the new accelerator complex at GSI, investigations in the field of high-energy spin physics
with the use of a polarized antiproton beam are planned. In this paper the possibilities for triggering are considered taking
into account the PAX detector properties and a probable configuration of the trigger system is discussed for the first time.
The text was submitted by the authors in English. 相似文献
997.
A. Vukics H. Ritsch 《The European Physical Journal D - Atomic, Molecular, Optical and Plasma Physics》2007,44(3):585-599
We present a framework for efficiently performing Monte Carlo
wave-function simulations in cavity QED with moving particles. It
relies heavily on the object-oriented programming paradigm as realised
in C++, and is extensible and applicable for simulating open
interacting qua
ntum dynamics in general. The user is provided with a
number of “elements”, e.g. pumped moving particles, pumped lossy
cavity modes, and various interactions to compose complex interacting
systems, which contain several particles moving in electromagnetic
fields of various configurations, and perform wave-function
simulations on such systems. A number of tools are provided to
facilitate the implementation of new elements. 相似文献
998.
Numerical studies were conducted to investigate the natural convection heat transfer around a uniformly heated thin plate
with arbitrary inclination in an infinite space. The numerical approach was based on the finite volume technique with a nonstaggered
grid arrangement. For handling the pressure–velocity coupling the SIMPLE-algorithm was used. QUICK scheme and first order
upwind scheme were employed for discretization of the momentum and energy convective terms respectively. Plate width and heating
rate were used to vary the modified Rayleigh number over the range of 4.8×106 to 1.87×108. Local and average heat transfer characteristics were compared with regarding to the inclination angle. The empirical expressions
for local and average Nusselt number were correlated. It has been found that for inclination angle less than 10∘, the flow and heat transfer characteristics are complicated and the average Nusselt number can not be correlated by one equation
while for inclination angle larger than 10∘, the average Nusselt number can be correlated into an elegant correlation.
Received on 18 April 2001 / Published online: 29 November 2001 相似文献
999.
Barannikov V. P. Guseinov S. S. V'ugin A. I. 《Russian Journal of Coordination Chemistry》2002,28(3):153-162
A review of the experimental and theoretical studies of the crown ether complexes with polar molecules in their crystals, solutions, and in a gas phase is given. The type of the molecular bonds in the complexes, their stoichiometry, and the change in the macrocycle conformation during complex formation are considered, as well as the effect of the macrocycle structure and the nature of the medium on the efficiency of the molecular bonding. New data are given on the enthalpies of transfer of the crown ethers from tetrachloromethane into solvents capable of forming hydrogen bonds. The enthalpies of specific interactions of macrocycles with the molecules of the solvents in the medium of the same solvents are characterized. The conformations of the crown ethers in the media under study are discussed. 相似文献
1000.