25 research outputs found

    Determining crystal structures through crowdsourcing and coursework

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    We show here that computer game players can build high-quality crystal structures. Introduction of a new feature into the computer game Foldit allows players to build and real-space refine structures into electron density maps. To assess the usefulness of this feature, we held a crystallographic model-building competition between trained crystallographers, undergraduate students, Foldit players and automatic model-building algorithms. After removal of disordered residues, a team of Foldit players achieved the most accurate structure. Analysing the target protein of the competition, YPL067C, uncovered a new family of histidine triad proteins apparently involved in the prevention of amyloid toxicity. From this study, we conclude that crystallographers can utilize crowdsourcing to interpret electron density information and to produce structure solutions of the highest quality

    Calculation of the Shock Wave From an Underground Nuclear Explosion in Granite

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    The capability of calculating the close-in effects of the shock wave from an underground nuclear explosion has been demonstrated. Agreement was obtained between calculation and measurements using a spherically symmetric, hydrodynamic, elastic-plastic code called SCC for the Hardhat event, a 5-kiloton nuclear detonation in granite. This capability is dependent upon having a more or less complete description of the elastic and dynamic properties of the materials involved. When this information is available, agreement within the limits of uncertainty of the measurements can be calculated for peak pressures, peak particle velocities, shock wave time of arrival, and pressure pulse shapes. (auth

    Some studies of deeply buried high explosive rock fracturing

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    Thermomechanical scoping calculations for the waste package environment tests

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    During the site characterization phase of the Nevada Nuclear Waste Storage Investigation Project, tests are planned to provide field information on the hydrological and thermomechanical environment. These results are needed for assessing performance of stored waste packages emplaced at depth in excavations in a rock mass. Scoping calculations were performed to provide information on displacements and stress levels attained around excavations in the rock mass from imposing a thermal load designed to simulate the heat produced by radioactive decay. In this way, approximate levels of stresses and displacements are available for choosing instrumentation type and sensitivity as well as providing indications for optimizing instrument emplacement during the test. 7 refs., 9 figs., 1 tab
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