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mol2any: get feature names from elements (#106) Code-Analysis #449: Commit a2ad223 pushed by JochenSiegWork
November 21, 2024 12:21 6m 15s main
main
November 21, 2024 12:21 6m 15s
Merge branch 'main' into get_feature_names Code-Analysis #448: Commit 0e5fc5b pushed by JochenSiegWork
November 21, 2024 10:25 6m 8s get_feature_names
get_feature_names
November 21, 2024 10:25 6m 8s
fix wrong fingerprint usage Code-Analysis #447: Commit 03b1e81 pushed by JochenSiegWork
November 21, 2024 10:18 6m 15s get_feature_names
get_feature_names
November 21, 2024 10:18 6m 15s
109 chemprop predictions fail for a single molecule (#110) Code-Analysis #446: Commit 2a3ef6e pushed by c-w-feldmann
November 21, 2024 09:58 5m 37s main
main
November 21, 2024 09:58 5m 37s
fix newly introduced bugs Code-Analysis #445: Commit 1963396 pushed by c-w-feldmann
November 21, 2024 08:30 5m 27s 109-chemprop-predictions-fail-for-a-single-molecule
109-chemprop-predictions-fail-for-a-single-molecule
November 21, 2024 08:30 5m 27s
black Code-Analysis #444: Commit 967ce17 pushed by c-w-feldmann
November 20, 2024 18:02 5m 32s 109-chemprop-predictions-fail-for-a-single-molecule
109-chemprop-predictions-fail-for-a-single-molecule
November 20, 2024 18:02 5m 32s
finalize test Code-Analysis #443: Commit 8cfc27c pushed by c-w-feldmann
November 20, 2024 18:00 5m 11s 109-chemprop-predictions-fail-for-a-single-molecule
109-chemprop-predictions-fail-for-a-single-molecule
November 20, 2024 18:00 5m 11s
don't squeeze to hard! Ensuring atleast1d Code-Analysis #442: Commit e279563 pushed by c-w-feldmann
November 20, 2024 18:00 5m 33s 109-chemprop-predictions-fail-for-a-single-molecule
109-chemprop-predictions-fail-for-a-single-molecule
November 20, 2024 18:00 5m 33s
add tests for occurring bug Code-Analysis #441: Commit 8c282a4 pushed by c-w-feldmann
November 20, 2024 17:27 5m 30s 109-chemprop-predictions-fail-for-a-single-molecule
109-chemprop-predictions-fail-for-a-single-molecule
November 20, 2024 17:27 5m 30s
try to add further SHAP explainers Code-Analysis #440: Commit 9d236b9 pushed by JochenSiegWork
November 20, 2024 16:45 2m 50s explainability_module
explainability_module
November 20, 2024 16:45 2m 50s
SmilesToMol: remove_hydrogens flag (#108) Code-Analysis #439: Commit 78b0fe0 pushed by c-w-feldmann
November 20, 2024 16:43 5m 40s 109-chemprop-predictions-fail-for-a-single-molecule
109-chemprop-predictions-fail-for-a-single-molecule
November 20, 2024 16:43 5m 40s
linting Code-Analysis #438: Commit 1ef31c0 pushed by JochenSiegWork
November 20, 2024 15:30 3m 8s explainability_module
explainability_module
November 20, 2024 15:30 3m 8s
linting Code-Analysis #437: Commit a0ed00e pushed by JochenSiegWork
November 20, 2024 14:45 2m 51s explainability_module
explainability_module
November 20, 2024 14:45 2m 51s
explainability: Explanation datastructures using mixins Code-Analysis #436: Commit adaa3e3 pushed by JochenSiegWork
November 20, 2024 14:32 3m 2s explainability_module
explainability_module
November 20, 2024 14:32 3m 2s
explainability: use all atoms instead of heavy atoms Code-Analysis #435: Commit ef338d3 pushed by JochenSiegWork
November 20, 2024 13:10 6m 20s explainability_module
explainability_module
November 20, 2024 13:10 6m 20s
linting Code-Analysis #434: Commit ab1e2de pushed by JochenSiegWork
November 20, 2024 12:57 5m 36s get_feature_names
get_feature_names
November 20, 2024 12:57 5m 36s
linting Code-Analysis #433: Commit b3e79ee pushed by JochenSiegWork
November 20, 2024 12:41 2m 52s get_feature_names
get_feature_names
November 20, 2024 12:41 2m 52s
linting Code-Analysis #432: Commit 6e405b0 pushed by JochenSiegWork
November 20, 2024 12:37 2m 46s get_feature_names
get_feature_names
November 20, 2024 12:37 2m 46s
linting Code-Analysis #431: Commit c4c9904 pushed by JochenSiegWork
November 20, 2024 10:45 2m 47s get_feature_names
get_feature_names
November 20, 2024 10:45 2m 47s
Christians comments, logging test Code-Analysis #430: Commit d5705e4 pushed by JochenSiegWork
November 20, 2024 10:42 2m 53s get_feature_names
get_feature_names
November 20, 2024 10:42 2m 53s
Merge branch 'main' into get_feature_names Code-Analysis #429: Commit 8d1abd1 pushed by JochenSiegWork
November 18, 2024 15:44 6m 4s get_feature_names
get_feature_names
November 18, 2024 15:44 6m 4s
SmilesToMol: remove_hydrogens flag (#108) Code-Analysis #428: Commit 78b0fe0 pushed by JochenSiegWork
November 18, 2024 15:44 5m 39s main
main
November 18, 2024 15:44 5m 39s
isort Code-Analysis #427: Commit 7233a82 pushed by JochenSiegWork
November 18, 2024 15:15 5m 36s smiles_to_mol_explicit_hydrogens
smiles_to_mol_explicit_hydrogens
November 18, 2024 15:15 5m 36s
linting Code-Analysis #426: Commit 696ee93 pushed by JochenSiegWork
November 18, 2024 15:09 2m 50s smiles_to_mol_explicit_hydrogens
smiles_to_mol_explicit_hydrogens
November 18, 2024 15:09 2m 50s
SmilesToMol: remove_hydrogens flag Code-Analysis #425: Commit f558d1f pushed by JochenSiegWork
November 18, 2024 15:05 2m 49s smiles_to_mol_explicit_hydrogens
smiles_to_mol_explicit_hydrogens
November 18, 2024 15:05 2m 49s