Leveraging peak Australian compute to enable workflows for predictive structural biology at scale -- 2025 ABACBS workshop

Prerequisites

You’ll need a laptop with a web browser and a terminal. See also the Setup page.

You might want to brush up on the fundamentals of the Linux Shell for HPC.

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Acknowledgements

This tutorial is based on Intro2HPC.

This work is supported by Australian BioCommons via funding from Bioplatforms Australia. Bioplatforms Australia is funded by the National Collaborative Research Infrastructure Strategy (NCRIS).

Schedule

Setup
00:00 1. Logging on to Setonix
00:07 2. Pull the nf-proteinfold workflow
00:17 3. Basics of Interacting with SLURM Scheduler
00:42 4. Edit the config
00:55 5. Launching the job(s)
01:15 6. Evaluate outputs of proteinfold
01:35 Finish

The actual schedule may vary slightly depending on the topics and exercises chosen by the instructor.