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Biosciences Working Group Update Wilfred W. Li, Ph.D., UCSD, USA Habibah Wahab, Ph.D., USM, Malaysia Daejeon, Korea, March 24, 2009
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iDRiC Workshop Infectious diseases research Epidemiological research Cyberinfrastructure development panel discussion From the Biosciences WG perspective: – very effective in getting our activities known to local researchers – further research scholar exchange opportunities discussed
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Breakout Session 1 CNIC – Avian Flu Virtual Screening Database – Dr. Baoping Yan – Monitoring Flu Outbreaks at Qinghai Lake – Guanyuan Liu KISTI – Drug Screener-G – Dr. Jincheol Kim ASGC – Grid enabled Virtual Screening Service – Mason Hsiung UCSD – CADD Pipeline – Wilfred Li CNRS – WISDOM PE – Ana da Costa
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Breakout Session 2 Issue 1: different types of clients, different types of infrastructure/grid middleware – Drug Screener-G from KISTI, CNRS – Grid Enabled Virtual Screening Service from ASGC – CADD pipeline from UCSD Proposed Solution: – Biological applications are better exposed as grid services/web services. Different clients may access services without worrying about how the jobs are distributed.
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Breakout Session 2 Issue 2: co-lead – Continuous participation of PRAGMA workshop and Biosciences WG sessions – Leading active projects in the cyberinfrastructure development in the Biosciences area – Familiar with international biogrid activities Proposed solution: – KISTI?
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Breakout Session 2 Issue 3: Avian Flu Grid datagrid GUI component – Gfarm 2.2 to be released – Opal2-CSF4 integration to be completed for TeraGrid execution of NAMD jobs SOAP attachment enables large input file transfer Software as a Service poorly supported by TG – MD trajectories remain to be managed efficiently through GUI Proposed solution: Simple relational database for metadata management Reduce the semantic layer for the time being
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Other planned activities Further integration of Gfarm for data sharing – Gfarm v2.0 shows significant improvement in performance and stability Opal-CSF4 release from sourceforge.net – This is driven by the execution of MD simulations on different TeraGrid sites and virtual screening using the PRAGMA grid NBCR summer institute – Would like to have a stable CADD pipeline release for use with the summer institute 2009
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Coming activities by visiting scholars and students Kevin Kejun Dong is visiting Calit2/SDSC/UCSD for 6 months – Use of Dataturbine for Tile Display Wall (TDW) and CAVE – Requires development of COVISE and Dataturbine clients PRIME students – Up to five PRIME students may work on Avian Flu Grid related research – USM – Malaysia; NTU – Taiwan; CNIC – China Possibility for new host sites for the PRIME project in 2010 – Jilin University – KISTI
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Thank you! KISTI Daejeon – Smart City Korea
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