Nimrod/K using Opal Services for Virtual Screening David Abramson, Ilkay Altintas, Daniel Crawl, Wilfred Li, Jane Ren, Jianwu Wang, Colin Enticott(presenter)

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Presentation transcript:

Nimrod/K using Opal Services for Virtual Screening David Abramson, Ilkay Altintas, Daniel Crawl, Wilfred Li, Jane Ren, Jianwu Wang, Colin Enticott(presenter)

Kepler The cross-project Kepler collaboration –UC Davis, UC Santa Barbara, and UC San Diego Workflow engine Tasks are represented by “actors” that can be placed on a canvas to construct a workflow. Has an inbuilt Opal actor that can call upon Opal WebServices

Nimrod/K Monash University Adds dynamic parallelism to Kepler which allows concurrent execution of Kepler’s actors.

Autodock Opal service National Biomedical Computation Resource Has a WebService interface for remote submission Supported by a 50 node cluster to allow concurrent processing of requests

Results Using Nimrod/K we were able to concurrently submit 10 requests to the Autodock Opal service and wait for the results to return. All requests were executed concurrently by the Autodock Opal service.

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