public class ReactionAtomMapping extends Object
Constructor and Description |
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ReactionAtomMapping() |
Modifier and Type | Method and Description |
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ambit2.reactions.mapping.ReactionAtomMapping.MappingStrategy |
getMapStrategy() |
Map<org.openscience.cdk.interfaces.IAtom,org.openscience.cdk.interfaces.IAtom> |
getReactionMapping(org.openscience.cdk.interfaces.IAtomContainer container1,
org.openscience.cdk.interfaces.IAtomContainer container2) |
void |
setMapStrategy(ambit2.reactions.mapping.ReactionAtomMapping.MappingStrategy mapStrategy) |
public Map<org.openscience.cdk.interfaces.IAtom,org.openscience.cdk.interfaces.IAtom> getReactionMapping(org.openscience.cdk.interfaces.IAtomContainer container1, org.openscience.cdk.interfaces.IAtomContainer container2)
public ambit2.reactions.mapping.ReactionAtomMapping.MappingStrategy getMapStrategy()
public void setMapStrategy(ambit2.reactions.mapping.ReactionAtomMapping.MappingStrategy mapStrategy)
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