#BioSimWW18 - Twitter Hashtag

almost 8 years ago

Links to all the workflows/tools presented at the joint @BioExcelCoE & @MolSSI_NSF workshop can be found in the thread 👇 #compchem #BioSimWW18 #BarceFLOWna

Karmen Condic-Jurkic @karmecon

almost 8 years ago

Day 2 at #SimBioWW18 starts with @soilandreyes going through the Common Workflow Language user guide and providing more details about CWL: https://t.co/yBZliSdWUF

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BioExcel CoE

@BioExcelCoE

almost 8 years ago

For all interested in the @BioExcelCoE - @MolSSI_NSF workshop, the slides are now available on our website #BioSimWW18

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Karmen Condic-Jurkic @karmecon

almost 8 years ago

Day 3 of @BioExcelCoE & @MolSSI_NSF joint workshop on biomolecular simulation workflows - time to answer some questions in terms of usability, sustainability, modularity and other *ities #BioSimWW18 #BarceFLOWna

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Karmen Condic-Jurkic @karmecon

almost 8 years ago

The afternoon session of #BioSimWW18 continues with the #AdaptiveMD - another python framework, but this time to simplify running MD simulations for Markov State Modeling. Info and tutorials here: https://t.co/DxmvFT2Hzt

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Karmen Condic-Jurkic @karmecon

almost 8 years ago

@lezzidan guides us through #PyCompss - a python based workflow developed by @bsc_compss (that Py was a bit of a giveaway). More info here: https://t.co/ZVLI42kuvX and tutorials and notebooks here: https://t.co/TASEPjCrQo #BioSimWW18

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Karmen Condic-Jurkic @karmecon

almost 8 years ago

#Fireworks relies on #MongoDB to store and access workflows for material science and everything you need to know about setting up some fireworks on your computer can be found here: https://t.co/DkdeEv4L0M #BioSimWW18

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BioExcel CoE

@BioExcelCoE

almost 8 years ago

We are on Day 2 of the @BioExcelCoE-@MolSSI_NSF workshop! Follow along using the hashtag #BioSimWW18 generously suggested by @karmecon

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Karmen Condic-Jurkic @karmecon

almost 8 years ago

More on adaptive sampling by Peter Kasson from University of Virginia - how analysis can drive decisions at the higher workflow level #BioSimWW18

karmecon's tweet photo. More on adaptive sampling by Peter Kasson from University of Virginia - how analysis can drive decisions at the higher workflow level #BioSimWW18 https://t.co/ZWdEaZrEYL

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Karmen Condic-Jurkic @karmecon

almost 8 years ago

John Ossyra talks about the #sampling problem in MD and the enhanced sampling methods require iterations, which leads us to workflows. #hashtagtesting #BioSimWW18