Empirical potentials for rovibrational energy transfer of hydrogen fluoride in collisions with argon

Rovibrational energy transfer of hydrogen fluoride in collisions with argon was investigated by using the coupled-states approximation to the quantum scattering problem. Empirically determined 3-D ab initio potential energy surfaces (PES) for the interaction between hydrogen fluoride and argon are presented. Second-order Møller-Plesset perturbation theory (MP2) was used to provide an initial approximate PES for the complex. The MP2 PES was subsequently modified to compensate for the underestimated dispersion interaction and adjusted until the desired agreement between calculated and observed spectroscopic quantities was achieved. Calculated rotational cross sections are in good agreement with experimental results as well as those obtained with a highly accurate vibrationally averaged empirical PES [J. M. Hutson, J. Chem. Phys. 96, 6752 (1992)]. The rate constants for the collision induced relaxation of the first vibrational state of hydrogen fluoride are presented as functions of temperature. The rate constants show structure at low temperature corresponding to cross-section resonances. The calculated rate constants are in good agreement with available high temperature experimental results. The calculations provide lower temperature rate constants and a wealth of detailed state-to-state information that are not available from experiment. © 2001 American Institute of Physics.Peer Reviewedhttp://deepblue.lib.umich.edu/bitstream/2027.42/71344/2/JCPSA6-115-10-4573-1.pd

Expansion of Foxp3+ T-cell populations by Candida albicans enhances both Th17-cell responses and fungal dissemination after intravenous challenge

Research Funding Wellcome Trust, UK. Grant Numbers: 086827, 080088 NIH. Grant Number: DE022550Peer reviewedPublisher PD

In Vivo Airway Surface Liquid Cl− Analysis with Solid-State Electrodes

The pathogenesis of cystic fibrosis (CF) airways disease remains controversial. Hypotheses that link mutations in CFTR and defects in ion transport to CF lung disease predict that alterations in airway surface liquid (ASL) isotonic volume, or ion composition, are critically important. ASL [Cl−] is pivotal in discriminating between these hypotheses, but there is no consensus on this value given the difficulty in measuring [Cl−] in the “thin” ASL (∼30 μm) in vivo. Consequently, a miniaturized solid-state electrode with a shallow depth of immersion was constructed to measure ASL [Cl−] in vivo. In initial experiments, the electrode measured [Cl−] in physiologic salt solutions, small volume (7.6 μl) test solutions, and in in vitro cell culture models, with ≥93% accuracy. Based on discrepancies in reported values and/or absence of data, ASL Cl− measurements were made in the following airway regions and species. First, ASL [Cl−] was measured in normal human nasal cavity and averaged 117.3 ± 11.2 mM (n = 6). Second, ASL [Cl−] measured in large airway (tracheobronchial) regions were as follows: rabbit trachea and bronchus = 114.3 ± 1.8 mM; (n = 6) and 126.9 ± 1.7 mM; (n = 3), respectively; mouse trachea = 112.8 ± 4.2 mM (n = 13); and monkey bronchus = 112.3 ± 10.9 mM (n = 3). Third, Cl− measurements were made in small (1–2 mm) diameter airways of the rabbit (108.3 ± 7.1 mM, n = 5) and monkey (128.5 ± 6.8 mM, n = 3). The measured [Cl−], in excess of 100 mM throughout all airway regions tested in multiple species, is consistent with the isotonic volume hypothesis to describe ASL physiology

The pH-dependence of lipid-mediated antimicrobial peptide resistance in a model Staphylococcal plasma membrane: a two-for-one mechanism of epithelial defence circumvention.

The mechanisms of membrane defence by lysylphosphatidylglycerol (LPG), were investigated using synthetic biomimetic mono- and bilayer models of methicillin resistant S. aureus ST239 TW, based on its lipid composition in both pH 7.4 (28% LPG) and pH 5.5 (51% LPG) cultures. These models incorporated a stable synthetic analogue of LPG (3adLPG) to facilitate long-duration biophysical studies, which were previously limited by the lability native LPG. Both increased 3adLPG content and full headgroup ionization at pH 5.5, increased bilayer order and dampened overall charge, via the formation of neutral ion pairs with anionic lipids. Ion pair formation in air/liquid interface lipid monolayers elicited a significant condensing effect, which correlated with the inhibition of subphase-injected magainin 2 F5W partitioning. In fluid phase lipid vesicles, increasing the proportion of 3adLPG from 28 to 51 mol% completely inhibited the adoption of the membrane-active ?-helical conformation of the peptide, without the need for full headgroup ionization. Neutron reflectivity measurements performed on biomimetic PG/3adLPG fluid floating bilayers, showed a significant ordering effect of mild acidity on a bilayer containing 30 mol% 3adLPG, whilst peptide binding/partitioning was only fully inhibited in a bilayer with 55 mol% 3adLPG at pH 5.5. These findings are discussed with respect to the roles of LPG in resistance to human epithelial defences in S. aureus and the continued evolution of this opportunistic pathogen’s virulence

Evidence of Silica Leakage to the Tropical Atlantic via Antarctic Intermediate Water during Marine Isotope Stage 4

Antarctic Intermediate Water (AAIW) and Subantarctic Mode Water (SAMW) are the main conduits for the supply of dissolved silica (silicic acid) from the deep Southern Ocean to the low latitude surface ocean, and therefore have an important control on low latitude diatom productivity. Enhanced supply of silicic acid by AAIW (and SAMW) during glacial periods may have enabled tropical diatoms to outcompete carbonate-producing phytoplankton, decreasing the relative export of inorganic to organic carbon to the deep ocean and lowering atmospheric CO2. This mechanism is known as the 'Silicic Acid Leakage Hypothesis' (SALH). Here we present records of neodymium and silicon isotopes from the western tropical Atlantic that provide the first direct evidence of increased silicic acid leakage from the Southern Ocean to the tropical Atlantic within AAIW during glacial Marine Isotope Stage (MIS) 4 (~60-80 ka). This leakage is coeval with enhanced diatom export in the NW Atlantic and across the eastern equatorial Atlantic and provides support for the SALH as a contributor to CO2 drawdown during full glacial development

Global Communication and Cross-Cultural Competence: Twenty-First Century Micro-Case Studies

Sensitivity to diversity now demands a strategic understanding of the importance of cross-cultural communication competence in every action in organizations, communities, and nations throughout the world. This article contains seven micro-cases, each of which highlights a discussion of communication and cultural impact. The cases range from issues related to handshakes, communication with powerful people, collaborating in a divergent culture, unintended impact in meetings, and regional pronunciation differences. The cases include discussion questions, references for additional reading, and one unique feature: a “bumper sticker” summary. The article features a section on Approaching the Challenges. This discusses major communication and cultural theories, which provides a basis for avoiding or reconciling differences. The concluding section, Extending Indirect Experiential Opportunities, advocates specific methods to evolve an individual’s global mind-set and communication capabilities

Superconducting and normal-state properties of the noncentrosymmetric superconductor Re3Ta

The noncentrosymmetric superconductor, Re3Ta, has been characterized in detail with a combination of magnetization, heat capacity, and electrical resistivity measurements, as well as a microscopic investigation of the internal magnetic fields using muon spin spectroscopy (μSR). In low applied fields, we observe 100% flux expulsion at a temperature of Tc = 4.68 K, which is concomitant with a sudden decrease of the electrical resistivity to zero and a sharp discontinuity in the heat capacity, confirming bulk superconductivity in this material. We find that Re3Ta is a poor metal, with superconductivity occurring in the dirty limit, and in which the disorder in the structure dominates the physical properties. Zero-field μSR shows that the superconducting state preserves time-reversal symmetry, and transverse-field measurements of the superfluid density are well described by an isotropic s-wave model. A careful analysis of the internal field distribution reveals a high level of disorder in the vortex lattice. Furthermore, we have combined the experimental data and calculated the effective mass, carrier density, and electronic mean-free path in this material, and ultimately show that Re3Ta lies close to the unconventional region of the Uemura plot

The Stellar Populations of M33's Outer Regions IV: Inflow History and Chemical Evolution

We have modelled the observed color-magnitude diagram (CMD) at one location in M33's outskirts under the framework of a simple chemical evolution scenario which adopts instantaneous and delayed recycling for the nucleosynthetic products of Type II and Ia supernovae. In this scenario, interstellar gas forms stars at a rate modulated by the Kennicutt-Schmidt relation and gas outflow occurs at a rate proportional to the star formation rate (SFR). With this approach, we put broad constraints on the role of gas flows during this region's evolution and compare its [alpha/Fe] vs. [Fe/H] relation with that of other Local Group systems. We find that models with gas inflow are significantly better than the closed box model at reproducing the observed distribution of stars in the CMD. The best models have a majority of gas inflow taking place in the last 7 Gyr, and relatively little in the last 3 Gyr. These models predict most stars in this region to have [alpha/Fe] ratios lower than the bulk of the Milky Way's halo. The predictions for the present-day SFR, gas mass, and oxygen abundance compare favorably to independent empirical estimates. Our results paint a picture in which M33's outer disc formed from the protracted inflow of gas over several Gyr with at least half of the total inflow occurring since z ~ 1.Comment: 22 pages, 12 figures, accepted to MNRA

Exercise intervention to prevent falls and enhance mobility in community dwellers after stroke: a protocol for a randomised controlled trial

Background: Stroke is the most common disabling neurological condition in adults. Falls and poor mobility are major contributors to stroke-related disability. Falls are more frequent and more likely to result in injury among stroke survivors than among the general older population. Currently there is good evidence that exercise can enhance mobility after stroke, yet ongoing exercise programs for general community-based stroke survivors are not routinely available. This randomised controlled trial will investigate whether exercise can reduce fall rates and increase mobility and physical activity levels in stroke survivors. Methods and design: Three hundred and fifty community dwelling stroke survivors will be recruited. Participants will have no medical contradictions to exercise and be cognitively and physically able to complete the assessments and exercise program. After the completion of the pre-test assessment, participants will be randomly allocated to one of two intervention groups. Both intervention groups will participate in weekly group-based exercises and a home program for twelve months. In the lower limb intervention group, individualised programs of weight-bearing balance and strengthening exercises will be prescribed. The upper limb/cognition group will receive exercises aimed at management and improvement of function of the affected upper limb and cognition carried out in the seated position. The primary outcome measures will be falls (measured with 12 month calendars) and mobility. Secondary outcome measures will be risk of falling, physical activity levels, community participation, quality of life, health service utilisation, upper limb function and cognition. Discussion: This study aims to establish and evaluate community-based sustainable exercise programs for stroke survivors. We will determine the effects of the exercise programs in preventing falls and enhancing mobility among people following stroke. This program, if found to be effective, has the potential to be implemented within existing community services. Trial registration: The protocol for this study is registered with the Australian New Zealand Clinical Trials Registry (ACTRN12606000479505)

Isolation of an Asymmetric RNA Uncoating Intermediate for a Single-Stranded RNA Plant Virus

AbstractWe have determined the three-dimensional structures of both native and expanded forms of turnip crinkle virus (TCV), using cryo-electron microscopy, which allows direct visualization of the encapsidated single-stranded RNA and coat protein (CP) N-terminal regions not seen in the high-resolution X-ray structure of the virion. The expanded form, which is a putative disassembly intermediate during infection, arises from a separation of the capsid-forming domains of the CP subunits. Capsid expansion leads to the formation of pores that could allow exit of the viral RNA. A subset of the CP N-terminal regions becomes proteolytically accessible in the expanded form, although the RNA remains inaccessible to nuclease. Sedimentation velocity assays suggest that the expanded state is metastable and that expansion is not fully reversible. Proteolytically cleaved CP subunits dissociate from the capsid, presumably leading to increased electrostatic repulsion within the viral RNA. Consistent with this idea, electron microscopy images show that proteolysis introduces asymmetry into the TCV capsid and allows initial extrusion of the genome from a defined site. The apparent formation of polysomes in wheat germ extracts suggests that subsequent uncoating is linked to translation. The implication is that the viral RNA and its capsid play multiple roles during primary infections, consistent with ribosome-mediated genome uncoating to avoid host antiviral activity