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    • The implementation of GEMS, a Grid-based molecular simulator, on the EGEE Grid environment is presented. We discuss the main issues related to the porting of the application on the EGEE Grid platform and the creation of the VO CompChem for the community of Computational Chemists. The real-time visualization of some reaction’s magnitudes on Virtual Monitors is also discussed.


    Utilizza questo identificativo per citare o creare un link a questo documento: http://hdl.handle.net/11391/22562

    Titolo: A Grid Molecular Simulator for E-Science
    Autori interni: GERVASI, Osvaldo
    LAGANA', Antonio
    Data di pubblicazione: 2005
    Rivista: LECTURE NOTES IN COMPUTER SCIENCE  
    Abstract: The implementation of GEMS, a Grid-based molecular simulator, on the EGEE Grid environment is presented. We discuss the main issues related to the porting of the application on the EGEE Grid platform and the creation of the VO CompChem for the community of Computational Chemists. The real-time visualization of some reaction’s magnitudes on Virtual Monitors is also discussed.
    Handle: http://hdl.handle.net/11391/22562
    ISBN: 978-3-540-32036-4
    Appare nelle tipologie:4.1 Contributo in Atti di convegno

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