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Rework Transfer_learning notebook #10

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Merged
AVHopp merged 9 commits into from
Feb 10, 2026
Merged

Rework Transfer_learning notebook #10

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611083c
WIP
AVHopp Feb 2, 2026
e4df799
Rework Transfer_Learning notebook
AVHopp Feb 2, 2026
818bb27
Fix typo in variable name
AVHopp Feb 2, 2026
9f5ac99
Correct type hint
AVHopp Feb 2, 2026
5c3bd52
Refactor temperature parameter to lab parameter
AVHopp Feb 9, 2026
802db78
Convert to Jupyter Notebook
AVHopp Feb 9, 2026
07b9c84
Rename dataset
AVHopp Feb 9, 2026
c9f9f69
Update CHANGELOG
AVHopp Feb 9, 2026
2085897
Reintroduce original dataset
AVHopp Feb 9, 2026
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1 change: 1 addition & 0 deletions CHANGELOG.md
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Expand Up @@ -13,6 +13,7 @@ and this project adheres to [Semantic Versioning](https://semver.org/spec/v2.0.0
- CI tests for execution of notebooks and changes in CHANGELOG
- Basic description and infrastructure
- Jupyter notebook version of the reaction optimization notebook
- Jupyter notebook version of the transfer learning notebook

### Changed
- Update from BayBE version 0.13.0 to 0.14.2
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3,456 changes: 1,728 additions & 1,728 deletions data/shields.csv
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1,729 changes: 1,729 additions & 0 deletions data/shields_tl.csv
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