1. Running a Scientific Experiment on the Grid Vilnius, 13 rd May, 2008 by Tomasz Szepieniec IFJ PAN & CYFRONET

2. T.Szepieniec AT cyfronet.pl; 13 May 2008, Grid Open Day, Vilnius Scientific Experiment ■ What it is?  set of observations performed in the context of solving a particular problem or question, to retain or falsify a hypothesis or research concerning phenomena. (wikipedia)‏  computations which a researcher need to run, to make progress in his/her research ■ Examples:  Monte Carlo simulations  Massive protein folding for testing releases of folding software  Simulation of a scheduling process using a new algorithm  Prepare an advance visualization of simulation results

3. T.Szepieniec AT cyfronet.pl; 13 May 2008, Grid Open Day, Vilnius Why running it on Grid? ■ Because time matters  Single sequential job? ► NO - a processor on your desktop has the same power  Make sense if the process is done in parallel ► high throughput computing ► multithreaded, parallel computation is our future! ■ Storing and sharing huge data is now possible ■ Access to specific machines  hardware supporting specific type of computation ► huge parallel installations  software available for lower/no cost

4. T.Szepieniec AT cyfronet.pl; 13 May 2008, Grid Open Day, Vilnius 4 GAUSSIAN VO VO for GAUSSIAN users operated by in EGEEII &III by CYFRONET (Krakow, Poland)‏ For users –everyone that accept the policy can join –easy to start – ready scripts.. –http://egee.grid.cyfronet.pl/Applications/gaussian-vo/http://egee.grid.cyfronet.pl/Applications/gaussian-vo/ For admins –sites with GAUSSIAN site licence can join –http://egee.grid.cyfronet.pl/Applications/gaussian-vo-how-to-support/http://egee.grid.cyfronet.pl/Applications/gaussian-vo-how-to-support/

5. T.Szepieniec AT cyfronet.pl; 13 May 2008, Grid Open Day, Vilnius Working group view: miracle of sharing resources ■ If there is a shortage of resource, SHARING is the solution ■ Typical stages of an experiment:  Preparing, Computing, Analyzing, (Writing a paper)‏  It does not refer to some researcher (e.g. solving Sierpinski problem)‏ ■ Sharing gives you more than you can obtain by keeping your part only demand resources Unused resources Unmet demand Figure copied from P. Plaszczak „Grid Computing”

6. T.Szepieniec AT cyfronet.pl; 13 May 2008, Grid Open Day, Vilnius Jump in? Before jumping see the other side…

7. T.Szepieniec AT cyfronet.pl; 13 May 2008, Grid Open Day, Vilnius Additonal effort required ■ Access to data becomes transfers ■ You should think about the following:  How many times I need to use it?  Location and size of data  Speed-up including overheads ► Parallel execution  Licensed software  Other people that uses produced data  Security level required

8. T.Szepieniec AT cyfronet.pl; 13 May 2008, Grid Open Day, Vilnius Also technical problems ■ Job sometimes fails – resubmission is required ■ Some sites are just wrongly configured! ■ We should not overflow VOs but use it efficiently ■ In some failures only the application operator should make decision what to do ■ Jobs are to quick (e.g. 10min)= submission overhead to large – we need put more workload to single grid job

9. T.Szepieniec AT cyfronet.pl; 13 May 2008, Grid Open Day, Vilnius Virtual Labolatory is all we need Figure copied from EU IST Virolab Project

10. T.Szepieniec AT cyfronet.pl; 13 May 2008, Grid Open Day, Vilnius Guideline #1 It is better to spend 60 minutes on preparing a tool than 3 minutes every day of doing work manually

11. T.Szepieniec AT cyfronet.pl; 13 May 2008, Grid Open Day, Vilnius Example: Rendering Application by Krzysztof Abramowicz, Cyfronet ■ Application: Visualization for L-system editor; user want to quickly create movie showing the results. ■ Goal: Limit movie generation time ■ Mean: Make parallel scenes rendering on the grid, using interactive connections between master and workers

12. T.Szepieniec AT cyfronet.pl; 13 May 2008, Grid Open Day, Vilnius Results: Quick preview for user

13. T.Szepieniec AT cyfronet.pl; 13 May 2008, Grid Open Day, Vilnius Guideline #2 The best possible grid is invisible.

14. T.Szepieniec AT cyfronet.pl; 13 May 2008, Grid Open Day, Vilnius Example: Grid application without grids by JUMC Team in EUChinaGrid Project, Kraków, Poland

15. T.Szepieniec AT cyfronet.pl; 13 May 2008, Grid Open Day, Vilnius Kind suggestions of conclusions ■ For researchers: To have more time for science, you need tools that improve your efficiency. The grid is one of them. ■ For grid developers and industry: Between an user and a grid middleware there is a gap that you are to bridge with tools that hide all which is not necessary for researcher to do science.