- all the java .class files with the MANIFEST to run it
To run this jar file:
- add all the JChem jar libraries into it at the root level
- run java -jar tanimotoSimilarityFP.jar

- all the java .class with the MANIFEST to run
To run it:
- add the JChem jar libraries into this jar file
- run java -jar prepareFingerPrints_yml.jar

this is only a draft, still with much hardcoded ugliness...

Patch 1

See merge request !2

Add new directory jChemSimilarityEFCFP containing the jChemSimilarityEFCFP_v2.jar archive. Returns the closest compounds, i.e. having the highest Tanimoto score.