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Pull requests: basf/MolPipeline

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Pull requests list

add classification threshold selection with GHOST
#183 opened Jun 17, 2025 by JochenSiegWork • Draft
@JochenSiegWork
fix pylint error
#182 opened Jun 16, 2025 by JochenSiegWork Loading…
Fix chemprop init with trainer
#181 opened Jun 13, 2025 by JenniferHem Loading…
@JenniferHem
11
Add samplers: oversampling and stochastic filtering/sampling of data sets
#176 opened May 14, 2025 by JochenSiegWork Loading…
@JochenSiegWork
Features from CSV file element
#172 opened May 6, 2025 by JochenSiegWork • Draft
@JochenSiegWork
Remove requires fitting and finalize routine
#167 opened Apr 24, 2025 by c-w-feldmann • Draft
@c-w-feldmann
Realize dev features
#162 opened Apr 17, 2025 by c-w-feldmann • Draft
4 tasks
@c-w-feldmann
Dataset similarity
#122 opened Feb 10, 2025 by JochenSiegWork • Draft
@JochenSiegWork
3
Update requirements chemprop to 2.0.5
#101 opened Oct 17, 2024 by c-w-feldmann • Draft
1
@c-w-feldmann
1
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