Phenalene-phosphazene complexes: effect of exocyclic charge densities on the cyclotriphosphazene ring system

The synthesis and properties of a new series of 1,9-diamino-substituted phenalene complexes of the cyclotriphosphazene ring system is described. One of the compounds is shown to be amphoteric, and this behavior allows an examination of the response of the phosphazene linkage to variations in exocyclic charge density at the spiro center in a plane perpendicular to the cyclotriphosphazene ring system. ^(31)P NMR spectroscopy indicates that substituent lone pairs with this orientation are not effective in long-range delocalization within the phosphazene linkage (in accord with our theoretical model of spiro delocalization). An X-ray crystal structure of one compound (7) identifies the presence of clathrated molecules of chloroform together with doubly hydrogen-bonded pairs of the phenalene-phosphazene complexes in the lattice. Crystal data for 7 (C_(13)H_8Cl_4N_5P_3•CHCl_3): monoclinic space group P2_1/c, a = 12.401 (4) Å, b = 28.404 (6) Å, c = 12.962 (3) Å, β = 91.76 (2)°, V = 4564 (2) Å^3, Z = 8, R = 0.050 for 4525 reflections

Key Information Technology Issues In Higher Education In The 1990s

The results of a delphi survey of the key information technology (IT) issues facing IS managers in college and universities in the U.S. in the 1990s are reported in this paper. The participants represent 161 colleges and universities that grant at least baccalaureate degrees. The study is similar to those conducted by the Society for Information Management (SIM) and the MIS Research Center (MISRC) at the University of Minnesota which have focused almost exclusively on the private sector, and studies sponsored by CAUSE, a nonprofit association concerned with the use and management of information technology in higher education. The purpose of the research is to identify the key issues facing higher education IS managers in the U.S. in the 1990s. This paper reports that the rank ordering of the key issues for the respondent institutions. The top key issues for research institutions include integrating new technologies into existing systems; improving user access to IS and communications systems; integrating systems and local area networks; managing administrative data resources; developing administrative support systems; establishing an information technology architecture; and improving IS strategic planning. Also reported are the issues on which significant differences exist between research and nonresearch institutions. The results indicate that the most critical IT issue facing public, nonresearch institutions is fundin

Coarse-grained protein-protein stiffnesses and dynamics from all-atom simulations

Large protein assemblies, such as virus capsids, may be coarse-grained as a set of rigid domains linked by generalized (rotational and stretching) harmonic springs. We present a method to obtain the elastic parameters and overdamped dynamics for these springs from all-atom molecular dynamics simulations of one pair of domains at a time. The computed relaxation times of this pair give a consistency check for the simulation, and (using a fluctuation-dissipation relationship) we find the corrective force needed to null systematic drifts. As a first application we predict the stiffness of an HIV capsid layer and the relaxation time for its breathing mode.Comment: 4 pages, 2 tables, 1 figure; v2: fixed a simulation to get much better agreement with experiment; v3: resolved issues in diffusion results, submitted to PR

Improving Mobility Performance in Low Vision With a Distance-Based Representation of the Visual Scene

Citation: van Rheede JJ, Wilson IR, Qian RI, Downes SM, Kennard C, Hicks SL. Improving mobility performance in low vision with a distancebased representation of the visual scene. Invest Ophthalmol Vis Sci. 2015;56:4802-4809. DOI:10.1167/ iovs.14-16311 PURPOSE. Severe visual impairment can have a profound impact on personal independence through its effect on mobility. We investigated whether the mobility of people with vision low enough to be registered as blind could be improved by presenting the visual environment in a distance-based manner for easier detection of obstacles. METHODS. We accomplished this by developing a pair of ''residual vision glasses'' (RVGs) that use a head-mounted depth camera and displays to present information about the distance of obstacles to the wearer as brightness, such that obstacles closer to the wearer are represented more brightly. We assessed the impact of the RVGs on the mobility performance of visually impaired participants during the completion of a set of obstacle courses. Participant position was monitored continuously, which enabled us to capture the temporal dynamics of mobility performance. This allowed us to find correlates of obstacle detection and hesitations in walking behavior, in addition to the more commonly used measures of trial completion time and number of collisions. RESULTS. All participants were able to use the smart glasses to navigate the course, and mobility performance improved for those visually impaired participants with the worst prior mobility performance. However, walking speed was slower and hesitations increased with the altered visual representation. CONCLUSIONS. A depth-based representation of the visual environment may offer low vision patients improvements in independent mobility. It is important for further work to explore whether practice can overcome the reductions in speed and increased hesitation that were observed in our trial

Targeted surveillance strategies for efficient detection of novel antibiotic resistance variants.

Genotype-based diagnostics for antibiotic resistance represent a promising alternative to empiric therapy, reducing inappropriate antibiotic use. However, because such assays infer resistance based on known genetic markers, their utility will wane with the emergence of novel resistance. Maintenance of these diagnostics will therefore require surveillance to ensure early detection of novel resistance variants, but efficient strategies to do so remain undefined. We evaluate the efficiency of targeted sampling approaches informed by patient and pathogen characteristics in detecting antibiotic resistance and diagnostic escape variants in Neisseria gonorrhoeae, a pathogen associated with a high burden of disease and antibiotic resistance and the development of genotype-based diagnostics. We show that patient characteristic-informed sampling is not a reliable strategy for efficient variant detection. In contrast, sampling informed by pathogen characteristics, such as genomic diversity and genomic background, is significantly more efficient than random sampling in identifying genetic variants associated with resistance and diagnostic escape

Seismic slip on an upper-plate normal fault during a large subduction megathrust rupture

Quantification of stress accumulation and release during subduction zone seismic cycles requires an understanding of the distribution of fault slip during earthquakes. Reconstructions of slip are typically constrained to a single, known fault plane. Yet, slip has been shown to occur on multiple faults within the subducting plate1 owing to stress triggering2, resulting in phenomena such as earthquake doublets3. However, rapid stress triggering from the plate interface to faults in the overriding plate has not been documented. Here we analyse seismic data from the magnitude 7.1 Araucania earthquake that occurred in the Chilean subduction zone in 2011. We find that the earthquake, which was reported as a single event in global moment tensor solutions4, 5, was instead composed of two ruptures on two separate faults. Within 12?s a thrust earthquake on the plate interface triggered a second large rupture on a normal fault 30?km away in the overriding plate. This configuration of partitioned rupture is consistent with normal-faulting mechanisms in the ensuing aftershock sequence. We conclude that plate interface rupture can trigger almost instantaneous slip in the overriding plate of a subduction zone. This shallow upper-plate rupture may be masked from teleseismic data, posing a challenge for real-time tsunami warning systems

Subject Lines as Sensors:Co-word Analysis of Email to Support the Management of Collaborative Engineering Work

This paper presents a topic-based analysis of email subject line data from a large-scale engineering project and explores its utility for supporting the management of collaborative work. The main contributions of the paper are a novel interpretation of the co-word network analysis method for application within an engineering project management context, and the appraisal of the method for d=finding patterns within subject line data. Our findings suggest that the approach has the potential to contribute to monitoring work complexity, tracking progress, recognizing synergy and divergence, detecting scope creep, and supporting knowledge capture

New Particles from Belle

I report recent results on hidden charm spectroscopy from Belle. These include: observation of a near-threshold enhancement in the omega-J/psi invariant mass distribution for exclusive B-->K omega J/psi decays; evidence for the decay X(3872)-->pi+pi-pi0 J/psi, where the pi+pi-pi0 invariant mass distribution has a strong peak between 750 MeV and the kinematic limit of 775 MeV, suggesting that the process is dominated by the sub-threshold decay X-->omega J/psi; and the observation of a peak near 3940 MeV in the J/psi recoil mass spectrum for the inclusive continuum process e+e- --> J/psi X. The results are based on a study of a 287 fb-1 sample of e+e- annihilation data collected at center- of-mass energies around the Upsilon(4S) in the Belle detector at the KEKB collider.Comment: 10 pages 12 figures. Invited talk at the 1st meeting of the APS Topical Group on Hadronic Physics, Fermilab, October 24-26, 2004; revised to correct some reference

A reflective journal as learning process and contribution to quality and validity in interpretative phenomenological analysis

Using selected, contemporaneous illustrations from the reflective journal of a doctoral student undertaking data analysis for the first time, this article examines the relationship between journaling as a learning process when undertaking computer-assisted qualitative data analysis and establishing quality and validity in interpretative phenomenological analysis. The writing of the journal is shown both to enact some potential validity criteria (e.g. in producing an audit trail) whilst also recording and reflectively prompting the process of learning, interpretation and bracketing, thus evidencing transparency. By using a journal inside the software package and alongside the stages of the interpretative phenomenological analysis, analysis within the software package, it is argued that quality and validity become dynamic, not static constructs. These constructs are intimately linked to the researcher-learning-process and permit a critical stance to be taken