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fix: move similarity-screen-rdkit 'derived-from' to annotation-properties #30

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Merged
tdudgeon merged 1 commit into from
Aug 13, 2026
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fix: move similarity-screen-rdkit 'derived-from' to annotation-properties #30

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4 changes: 2 additions & 2 deletions data-manager/rdkit.yaml
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Original file line number Diff line number Diff line change
Expand Up @@ -944,7 +944,7 @@ jobs:
Filters molecules by molecular similarity using RDKit.
A number of descriptors and metrics are available.
Query molecule(s) are specified from a project file or as SMILES.
version: '1.0.1'
version: '1.0.2'
category: comp chem
keywords:
- rdkit
Expand Down Expand Up @@ -1048,7 +1048,7 @@ jobs:
Geometric mean of similarities
required: true
active: true
derived-from: inputFile
derived-from: inputFile
options:
type: object
required:
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