Package | Description |
---|---|
uk.ac.ebi.reactionblast.stereo.compare | |
uk.ac.ebi.reactionblast.stereo.tools | |
uk.ac.ebi.reactionblast.stereo.wedge |
Modifier and Type | Method and Description |
---|---|
static WedgeStereoComparisonResult |
WedgeStereoComparisonTool.compare(org.openscience.cdk.interfaces.IAtom atomA,
org.openscience.cdk.interfaces.IAtomContainer atomContainerA,
org.openscience.cdk.interfaces.IAtom atomB,
org.openscience.cdk.interfaces.IAtomContainer atomContainerB,
WedgeStereoLifter lifter) |
Modifier and Type | Method and Description |
---|---|
static IStereoAndConformation |
Chirality2DTool.getChirality2D(WedgeStereoLifter lifter,
org.openscience.cdk.interfaces.IAtom atom,
org.openscience.cdk.interfaces.IAtomContainer atomContainer) |
Modifier and Type | Method and Description |
---|---|
static WedgeStereoAnalysisResult |
WedgeStereoAnalyser.getResult(org.openscience.cdk.interfaces.IAtom atom,
org.openscience.cdk.interfaces.IAtomContainer atomContainer,
WedgeStereoLifter lifter) |