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11:00 – Noon SEAGrid Web and Desktop Portals - Sudhakar Pamidighantam

Noon - 1– 1:00 pm Gateway Middleware Architectures: Apache Airavata – IU Remote Suresh Marru

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8:00 pm Workshop Dinner: Speaker TBD 

 

Wednesday May 10, 2017

910:00 – 1011:00 am Teresa Head-Gordon MolSSI Vision

1011:00 – 11:00 am Noon Yassin Jeilani: Using SEAGrid for Undergraduate Research

11Noon – 1:00 – Noon pm Deploying Resources and Applications in SEAGrid – Sudhakar Pamidighantam

Noon 1:00 12:00 pm Lunch Break

12:00 – 23:00 pm Robert Cave NSF – Vision NSF Chemistry Programs:

 23:00 – 34:00 pm SEAGrid Science Exemplars - Sudhakar PamidighantanPamidighantam

 34:00 – 34:15 Break

 3 4:15 – 45:00 pm SEAGrid Hands On Session 3: Identify new applications from audience to be deployed and deploy an application and Hands on: Use the application to submit a job.

 4 5:00 -5– 6:30 pm Panel Discussion –  MolSSI and student requirements and how Gateways can support them (students who have not presented should be encouraged to participate) NSF, SGCI, MolSSI participants expected – Sudhakar, Jerzy, Teresa, Suresh, Nancy, Linda, Daniel, Dr. Cave

 5 6:30 pm Adjourn

 

Thursday May 11, 2017 

910:00 –11:00 am – Noon Student Requirements – Lightning Talks from students 10 Min each from selected students: Research, Resources, Future (graduation and post-graduation) needs

11:00 Noon 1112:30 pm Extension to SEAGrid – Application GUI’s,  Jupyter Notebooks and Workflows – Sudhakar Pamidighantam

1112:30 – 121:00 pm Presentation of Certificates and Evaluation form fill-up

121:00 – 121:15 pm Conclusion and Vote of thanks    

121:15 – 121:45 pm Lunch, Workshop Report preparation

121:45 pm Adjourn