Distributed Multiscale Computing
Date: 03/Jun/2013 Time: 09:00 - 04/Jun/2013 Time: 18:00
The course will take place in Barcelona Supercomputing Centre, within the UPC Campus Nord premises, the Vertex Building (green on the map), room VS208. Please note that S signifies that for this room you need to go 2 floors below the entrance level which is elevated.
Primary tabs
Monday, June 3rd – Room V208
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09:00 - Start registration at PL-Grid (assisted by instructors)
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09:30 - Welcome (Alfons Hoekstra, University of Amsterdam/The Netherlands)
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09:45 - General Session: Introduction to Multiscale Modeling and Simulation
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Multiscale modeling and simulation (Alfons Hoekstra, University of Amsterdam/The Netherlands)
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Distributed Multiscale Computing (Alfons Hoekstra, University of Amsterdam/The Netherlands)
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12:00 - Lunch Break
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13:00 - Hands On Session 1: How to develop loosely coupled multiscale applications?
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Development using MAPPER Memory (MaMe), Multiscale Application Designer (MAD) and GridSpace (Katarzyna Rycerz, Eryk Ciepiela, Maciej Pawlik; Institute of Computer Science and CYFRONET, AGH, Cracow/Poland)
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Multiscale modeling of polymer electronics using Unicore (Ivan Kondov; Karlsruhe Institute of Technology/Germany, and Luca Grisanti; University of Mons/Belgium)
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15:45 - Coffee Break
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16:00 - Community Presentation: MAPPER (Alfons Hoekstra; University of Amsterdam/The Netherlands)
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16:30 - General Session (cont'd): Tools and Services for Distributed Multiscale Modeling
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QosCosGrid and Application Hosting Environment (AHE) (Derek Groen; University College London/United Kingdom, and Mariusz Mamonski; Poznan Supercomputing and Networking Center, Poznan/Poland)
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includes a demonstration of a Nanomaterial application (Derek Groen; University College London/United Kingdom)
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- 18:30 - End Day 1
Tuesday, June 4th – Room V208
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09:15 - Community Presentation: MMM@HPC (Ivan Kondov; Karlsruhe Institute of Technology/Germany)
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09:45 - Hands On Session 2: How to develop tightly coupled multiscale applications?
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Development using the Multiscale Coupling Library and Environment (MUSCLE) (Joris Borgdorff; University of Amsterdam/The Netherlands, and Derek Groen; University College London/United Kingdom, and Mariusz Mamonski; Poznan Supercomputing and Networking Center, Poznan/Poland)
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Development using the MPWide communication library (Derek Groen; University College London/United Kingdom)
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- 12:15 - Lunch Break
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13:15 - Community Presentation: ScalaLife (Agusti Emperador; Institute for Research in Biomedicine, Barcelona/Spain)
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13:45 - Hands On Session 3: How to Turn an Application into Multiscale?
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Demonstration using ScalaLife applications DALTON and GROMACS (Zilvinas Rinkevicius; Royal Institute of Technology, Stockholm/Sweden, and Mariusz Mamonski; Poznan Supercomputing and Networking Center, Poznan/Poland)
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15:45 - Coffee Break
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16:00 - Hands On Session 4: How to deploy multiscale applications on European e-Infrastructures?
- An assessment of deployment procedures for the European Grid Infrastructure (EGI) and the Partnership for Advanced Computing in Europe (PRACE) (Ilya Saverchenko; Ludwig-Maximilians-University, Munich/Germany and Leibniz Supercomputing Centre, Garching/Germany, and Mariusz Mamonski; Poznan Supercomputing and Networking Center, Poznan/Poland)
- 17:00 - Wrap up, Feedback, End of School