public interface IReactionBuilder
Modifier and Type | Method and Description |
---|---|
org.openscience.cdk.interfaces.IReactionSet |
getReactions() |
void |
process()
process the reaction process
|
void |
writeCompoundFingerPrints()
write the fingerprints in a file
|
void |
writeCompoundInChI()
write the InChi into a file
|
void |
writeReactions()
write the reaction in a file
|
org.openscience.cdk.interfaces.IReactionSet getReactions()
void process()
void writeCompoundFingerPrints()
void writeCompoundInChI()
void writeReactions()