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121.
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123.
Jesús S. Pérez Guerrero Todd H. Skaggs M. Th. van Genuchten 《Transport in Porous Media》2009,80(2):373-387
Transport equations governing the movement of multiple solutes undergoing sequential first-order decay reactions have relevance
in analyzing a variety of subsurface contaminant transport problems. In this study, a one-dimensional analytical solution
for multi-species transport is obtained for finite porous media and constant boundary conditions. The solution permits different
retardation factors for the various species. The solution procedure involves a classic algebraic substitution that transforms
the advection-dispersion partial differential equation for each species into an equation that is purely diffusive. The new
system of partial differential equations is solved analytically using the Classic Integral Transform Technique (CITT). Results
for a classic test case involving a three-species nitrification chain are shown to agree with previously reported literature
values. Because the new solution was obtained for a finite domain, it should be especially useful for testing numerical solution
procedures. 相似文献
124.
125.
Steffen Eller Stefano Mezzato Dr. Bas R. Leeflang Prof. Dr. Carlo Unverzagt Prof. Dr. F. Javier Cañada Prof. Dr. Jesús Jiménez‐Barbero 《Chemistry (Weinheim an der Bergstrasse, Germany)》2010,16(35):10715-10726
Protein‐carbohydrate interactions are at the heart of a variety of essential molecular recognition events. Hevein, a model lectin related to the superantigen family, recognizes the trisaccharide core of N‐glycoproteins ( 1 ). A combined approach of NMR spectroscopy and molecular modeling has permitted us to demonstrate that an Asn‐linked Man(GlcNAc)2 ( 2 ) is bound with even higher affinity than (GlcNAc)3. The molecular recognition process entails conformational selection of only one of the possibilities existing for chitooligosaccharides. The deduced 3D structure of the hevein/ 2 complex permits the extension of polypeptide chains from the Asn moiety of 2 , as well as glycosylation at Man O‐3 and Man O‐6 of the terminal sugar. Given the ubiquity of the Man(GlcNAc)2 core in all mammalian N‐glycoproteins, the basic recognition mode presented herein might be extended to a variety of systems with biomedical importance. 相似文献
126.
In recent years, Mitogen-Activated Protein Kinase (MAPK) pathways have emerged as major regulators of cellular physiology. In the fungal pathogen Candida albicans, three different MAPK pathways have been characterized in the last years. The HOG pathway is mainly a stress response pathway that is activated in response to osmotic and oxidative stress and also participates regulating other pathways. The SVG pathway (or mediated by the Cek1 MAPK) is involved in cell wall formation under vegetative and filamentous growth, while the Mkc1-mediated pathway is involved in cell wall integrity. Oxidative stress is one of the types of stress that every fungal cell has to face during colonization of the host, where the cell encounters both hypoxia niches (i.e. gut) and high concentrations of reactive oxygen species (upon challenge with immune cells). Two pathways have been shown to be activated in response to oxidative stress: the HOG pathway and the MKC1-mediated pathway while the third, the Cek1 pathway is deactivated. The timing, kinetics, stimuli and functional responses generated upon oxidative stress differ among them; however, they have essential functional consequences that severely influence pathogenesis. MAPK pathways are, therefore, valuable targets to be explored in antifungal research. 相似文献
127.
Garbiñe Álvarez Francisco Alcaide Oscar Miguel Laura Calvillo María Jesús Lázaro Jacob J. Quintana Juan Carlos Calderón Elena Pastor 《Journal of Solid State Electrochemistry》2010,14(6):1027-1034
This paper presents the behavior of ordered mesoporous carbon (OMC)-supported catalysts as anodes for direct methanol fuel
cells (DMFC), fed with an aqueous methanol solution. OMC samples were prepared by the nanocasting method from a polymerized
furan resin using mesoporous silica as a template. Pt and PtRu nanoparticles were supported on OMC with high dispersion, the
particle size being 2.4 nm at PtRu loading of 15 wt.%. The resulting catalysts were analyzed using carbon monoxide stripping
voltammetry, cyclic voltammetry, and chronoamperometry in three-electrode experiments and recording cell voltage vs. current
density curves in practical DMFC. It was found that PtRu-catalyzed technical electrodes exhibited good activity towards methanol
electrooxidation in half-cell experiments under fuel-cell-relevant conditions. Specifically, Pt85Ru15/OMC catalyst showed the highest catalytic enhancement compared to Pt/OMC for the steady-state electrooxidation of methanol
at 60 °C and 0.5 V, by a factor of 22 in 2-M MeOH solution. DMFC single cells yielded an open-circuit voltage of 0.625 V at
60 °C. Polarization curves indicate that DMFC with OMC-supported Pt85Ru15 catalyst at the anode exhibited the best performance. 相似文献
128.
Perea-Buceta JE Mota AJ Costes JP Sillanpää R Krzystek J Colacio E 《Dalton transactions (Cambridge, England : 2003)》2010,39(42):10286-10292
The reaction between Hmbpymca ligand (prepared in situ from the hydrolysis of 5-methyl-4-cyano-bispyrimidine with NaOH and further neutralization with 2 M HCl) and Mn(ClO(4))(2)·4H(2)O in 1:1 molar ratio afforded the triangulo-trimanganese(II) complex [Mn(3)(bpymca)(3)(H(2)O)(6)]Cl(3)·6H(2)O 1. The chloride anions in this complex come from the HCl used in the neutralization process. The molecular structure of 1 consists of cationic molecular triangles [Mn(3)(μ-mbpymca)(3)(H(2)O)(6)](3+) with C(3) symmetry, chloride anions and crystallization water molecules, all of them involved in an extensive network of hydrogen bonds, leading to a chiral network. Within the [Mn(3)(μ-mbpymca)(3)(H(2)O)(6)](3+) cations, seven-coordinated Mn(II) ions are bridged by both oxygen atoms of the carboxylate groups and exhibit a MnO(5)N(2) compressed pentagonal bipyramidal coordination environment. The temperature dependence of the magnetic susceptibility shows the presence of weak antiferromagnetic interactions between Mn(II) ions mediated by the carboxylate group of the mbpymca ligand and the existence of a 3D antiferromagnetic ordering below 4 K, which has its origin in the AF inter-trimer exchange interactions mediated by the strong hydrogen bonds present in the crystal of 1. The experimental magnetic susceptibility data above 7 K could be satisfactorily fitted to the theoretical analytical expression derived from the spin Hamiltonian H = -J(S(1)S(2) + S(1)S(3) + S(2)S(3)) with J = -0.782(3) cm(-1) and g = 2.092(3). The model predicts a degenerate ground state with an S = 1/2, which is typical of triangular trimetallic spin frustrated systems containing metal with non-integer spins. DFT calculations were performed on the molecular structure as found in the solid state to support the experimental J value and the Mn-O(carb)-Mn as the primarily exchange pathway. 相似文献
129.
This paper was based on a theoretical framework to determine strong and weak radiation by a guitar top plate, vibrating through deflections hard to analyze: multipolar mode shapes. The air-structure interaction was examined in terms of edge modes or corner modes, and considering even or odd number modes. A numerical model was implemented and experimentally calibrated, exhibiting several advantages exploring the coupling between vibratory and acoustic waves in a top plate. Two analyses were applied detecting high or low radiation efficiency for the structure. First, the addition of volume velocity for odd numbers of poles and cancellation for even numbers were examined. In fact, both behaviors can happen at the same time, as it was shown for a corner radiator case used as an example. Second, the ratio between bending and acoustic wavenumbers was explored. To illustrate the importance of this ratio, some theoretical features of a more efficient radiator than the corner mode were exposed in an edge mode example. Labeling multipolar mode shapes as efficient or inefficient radiators showed to be a useful alternative analyzing the top plate behavior. It can be applied knowing the nodal lines of the vibration pattern and estimating the bending and acoustic wavelengths. 相似文献
130.
Ansgar Jüngel José Luis López Jesús Montejo–Gámez 《Journal of statistical physics》2011,145(6):1661-1673
A quantum Navier–Stokes system for the particle, momentum, and energy densities is formally derived from the Wigner–Fokker–Planck
equation using a moment method. The viscosity term depends on the particle density with a shear viscosity coefficient which
equals the quantum diffusion coefficient of the Fokker–Planck collision operator. The main idea of the derivation is the use
of a so-called osmotic momentum operator, which is the sum of the phase-space momentum and the gradient operator. In this
way, a Chapman–Enskog expansion of the Wigner function, which typically leads to viscous approximations, is avoided. Moreover,
we show that the osmotic momentum emerges from local gauge theory. 相似文献