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Bionemo demos #2968

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Bionemo demos #2968

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NAEV95
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@NAEV95 NAEV95 commented Sep 27, 2024

updated bionemo demos examples from v1.0 to v1.8

  • updated demos to be run as notebooks
  • updated configs and required scripts to manage v1.8
  • downloading models directly from the notebooks

@NAEV95 NAEV95 marked this pull request as draft September 27, 2024 11:20
@NAEV95 NAEV95 closed this Sep 27, 2024
@NAEV95 NAEV95 reopened this Sep 27, 2024
@NAEV95 NAEV95 marked this pull request as ready for review September 27, 2024 16:53
@holgerroth holgerroth self-requested a review September 27, 2024 17:00
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/build

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@holgerroth holgerroth left a comment

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Left some minor comments

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Please address the comments.

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@YuanTingHsieh YuanTingHsieh left a comment

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great example

@@ -36,9 +40,9 @@ exp_manager:
tags:
- ${name}
offline: True # set to True if there are issues uploading to WandB during training
resume_if_exists: False # automatically resume if checkpoint exists
resume_if_exists: True # automatically resume if checkpoint exists
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if there are multiple global rounds, I vaguely remember in previous integration we need to set this to False? @holgerroth

YuanTingHsieh
YuanTingHsieh previously approved these changes Oct 1, 2024
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LGTM, other than that resume flag need confirmation from Holger

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/build

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@chesterxgchen chesterxgchen left a comment

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add few comments and questions
Overall, too many duplicated files with minor variation. For 2.5.1 this might be ok. But the final example for BioNemo 2.0, we should replace the duplication files with new Job APIs so we don't have so many files for just few minor changes

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@holgerroth we will need to add the PR for 2.5 branch if we want to include in 2.5.1 release

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/build

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4 participants