static java.util.List<RootSystem> |
SignatureRootFinder.findRootSystems(org.openscience.cdk.interfaces.IAtomContainer atomContainer,
java.util.List<org.openscience.cdk.interfaces.IBond> bondChanges,
java.util.List<org.openscience.cdk.interfaces.IAtom> atomChanges) |
static java.util.Map<org.openscience.cdk.interfaces.IAtomContainer,java.util.List<RootSystem>> |
SignatureRootFinder.findRootSystems(org.openscience.cdk.interfaces.IReaction reaction,
java.util.List<org.openscience.cdk.interfaces.IBond> bondChanges,
java.util.List<org.openscience.cdk.interfaces.IAtom> atomChanges) |
static java.util.List<RootSystem> |
SignatureRootFinder.findRootSystems(org.openscience.cdk.interfaces.IReaction reaction,
java.util.List<java.lang.String> signatureStrings) |
static java.util.Map<org.openscience.cdk.interfaces.IAtomContainer,java.util.List<RootSystem>> |
SignatureRootFinder.findRootSystems(RBlastReaction rblReaction) |