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project_automation.yaml
126 workflow runs
126 workflow runs

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recetox-aplcms: parse parameter line tool Add issues to project #140: Issue #623 opened by hechth
December 4, 2024 12:31 17s
December 4, 2024 12:31 17s
recetox-xmsannotator: redundancy filtering Add issues to project #139: Issue #622 opened by hechth
November 18, 2024 15:38 15s
November 18, 2024 15:38 15s
recetox-xmsannotator: compute confidence levels Add issues to project #138: Issue #621 opened by hechth
November 18, 2024 15:36 12s
November 18, 2024 15:36 12s
recetox-xmsannotator: pathway matching Add issues to project #137: Issue #620 opened by hechth
November 18, 2024 15:31 11s
November 18, 2024 15:31 11s
recetox-xmsannotator: compute chemscore Add issues to project #136: Issue #619 opened by hechth
November 18, 2024 15:21 13s
November 18, 2024 15:21 13s
recetox-xmsannotator: reformat annotation table and correlation matrix Add issues to project #135: Issue #618 opened by hechth
November 18, 2024 15:06 12s
November 18, 2024 15:06 12s
recetox-xmsannotator: compute isotopes Add issues to project #134: Issue #617 opened by hechth
November 18, 2024 15:03 13s
November 18, 2024 15:03 13s
recetox-xmannotator: compute_rt_modules Add issues to project #133: Issue #616 opened by hechth
November 18, 2024 14:54 13s
November 18, 2024 14:54 13s
recetox-xmsannotator: compute_peak_modules Add issues to project #132: Issue #615 opened by hechth
November 18, 2024 14:48 12s
November 18, 2024 14:48 12s
recetox-xmsannotator: compute_peak_correlations Add issues to project #131: Issue #614 opened by hechth
November 18, 2024 14:44 15s
November 18, 2024 14:44 15s
reetox-xmsannotator: compute mass defect Add issues to project #130: Issue #613 opened by hechth
November 18, 2024 14:28 14s
November 18, 2024 14:28 14s
recetox-xmsannotator: simple annotation Add issues to project #129: Issue #612 opened by hechth
November 18, 2024 14:26 14s
November 18, 2024 14:26 14s
qcxms: remove 'input in' files from neutral run output for each trajectory and use single file as input, as the file for each trajectory contains the same parameters anyway Add issues to project #128: Issue #611 opened by hechth
November 18, 2024 13:59 16s
November 18, 2024 13:59 16s
ms target screen: improve documentation Add issues to project #127: Issue #609 opened by hechth
November 14, 2024 10:35 15s
November 14, 2024 10:35 15s
scipy interpolate tool Add issues to project #126: Issue #608 opened by hechth
November 7, 2024 14:29 12s
November 7, 2024 14:29 12s
recetox-aplcms: version update 0.13.4 Add issues to project #125: Issue #604 opened by hechth
October 30, 2024 19:27 14s
October 30, 2024 19:27 14s
mfassignr: version update 1.1.2 Add issues to project #124: Issue #603 opened by hechth
October 30, 2024 09:37 10s
October 30, 2024 09:37 10s
waveica: accept tables with additional columns Add issues to project #123: Issue #602 opened by hechth
October 29, 2024 07:55 13s
October 29, 2024 07:55 13s
recetox-aplcms: revert changes to correct time tool Add issues to project #122: Issue #600 opened by hechth
October 29, 2024 07:20 13s
October 29, 2024 07:20 13s
MS target screen: Id column in written as float instead of integer Add issues to project #121: Issue #598 opened by hechth
October 23, 2024 13:37 13s
October 23, 2024 13:37 13s
MS target screen: accept tabulars as inputs for the peak tables Add issues to project #120: Issue #597 opened by hechth
October 23, 2024 12:58 12s
October 23, 2024 12:58 12s
MFAssignR: re-implement the selection of most suitable recalibration series Add issues to project #119: Issue #593 opened by KristinaGomoryova
October 16, 2024 09:52 14s
October 16, 2024 09:52 14s
MFAssignR: include more parameters to MFAssign function Add issues to project #118: Issue #592 opened by KristinaGomoryova
October 16, 2024 09:21 10s
October 16, 2024 09:21 10s
Add issues to project Add issues to project #117: opened by KristinaGomoryova
October 16, 2024 09:19 11s
October 16, 2024 09:19 11s
MFAssignR: add more parameters to MFAssignCHO function Add issues to project #116: Issue #590 opened by KristinaGomoryova
October 16, 2024 09:15 15s
October 16, 2024 09:15 15s