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Adds ATM tutorial, along with livecomms update
#30
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OpenBioSim/biosimspace_tutorials:main
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feature_ATM_tutorial
OpenBioSim/biosimspace_tutorials:feature_ATM_tutorial
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Nov 24, 2024
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Merged
Adds ATM tutorial, along with livecomms update
#30
lohedges
merged 9 commits into
main
OpenBioSim/biosimspace_tutorials:main
from
feature_ATM_tutorial
OpenBioSim/biosimspace_tutorials:feature_ATM_tutorial
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Commits
Commits on Oct 31, 2024
ATM tutorial
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Commits on Nov 14, 2024
Updates livecomms article with section on ATM.
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Commits on Nov 18, 2024
Removes example outputs in preparation for switching to remote download
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Adds remote download of example output folder
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Commits on Nov 19, 2024
Updates ATM tutorial with cut-down minimisation and equilibration protocols, allowing them to be run using minimal resources.
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Updates number of steps for minimisation to ensure stability, adds comment telling the user that minimisation may take a few minutes
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Fix text before annealing step to mention proper runtime
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Commits on Nov 20, 2024
Rename ATM notebook for consistency
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Commits on Nov 21, 2024
Trim empty cell from bottom of notebook
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