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See:
Description
| Interface Summary | |
|---|---|
| StructureFixer | A StructureFixer can fix a Molecule problem identified by a
StructureCheckerResult |
| Class Summary | |
|---|---|
| AbsoluteStereoFixer | A StructureFixer implementation which removes absolute stereo property from the molecule. |
| AbstractStructureFixer | This class is the default abstract implementation of StructureFixer interface |
| CleanFixer | A descendant of AbstractStructureFixer which cleans the molecule in 2d |
| ContractGroupFixer | A descendant of AbstractStructureFixer which contracts the abbreviated groups in the molecule |
| ConvertAliasToGroupFixer | A descendant of AbstractStructureFixer which converts the aliases to contracted abbreviated groups in the molecule |
| ConvertPseudoToGroupFixer | A descendant of AbstractStructureFixer which converts the pseudo informations to
contracted abbreviated groups in the molecule |
| ConvertToAtomFixer | A descendant of AbstractStructureFixer which converts the aliases to atom with
atom number contained in the alias information |
| ConvertToCarbonFixer | A descendant of AbstractStructureFixer which converts pseudo atoms to carbon atoms |
| CrossedDoubleBondFixer | A descendant of AbstractStructureFixer which converts crossed double bond to wiggly |
| ExpandGroupFixer | A descendant of AbstractStructureFixer which expands all abbreviated groups in the molecule |
| IsotopeFixer | A descendant of AbstractStructureFixer which converts the isotopes to non isotope atoms |
| MapMoleculeFixer | A descendant of AbstractStructureFixer which maps the atoms of the molecule incrementally |
| MapReactionFixer | A descendant of AbstractStructureFixer which maps the reaction with AutoMapper |
| MetalloceneFixer | A descendant of AbstractStructureFixer which converts a single incorrectly drawn
metallocene into multicenter based coordinate bond representation. |
| PartialCleanFixer | WARNING! |
| RearomatizeFixer | A descendant of AbstractStructureFixer which rearomatize the molecule |
| RemoveAtomFixer | A descendant of AbstractStructureFixer which removes the atoms of the molecule
signed in the result |
| RemoveAtomMapFixer | A descendant of AbstractStructureFixer which removes the atom maps from the molecule |
| RemoveAtomValueFixer | A descendant of AbstractStructureFixer which removes the atom value from the molecule |
| RemoveAttachedDataFixer | A descendant of AbstractStructureFixer which removes the attached data from the molecule |
| RemoveBondFixer | A descendant of AbstractStructureFixer which removes the bonds of the molecule
signed by the result |
| RemoveRadicalFixer | A descendant of AbstractStructureFixer which removes the radicals from the
atoms of the molecule |
| UngroupFixer | A descendant of AbstractStructureFixer which ungroups all abbreviated groups
in the molecule |
| ValenceFixer | A descendant of AbstractStructureFixer which fixes valence problem in the
molecule if it is possible with removing explicit hydrogens or by adding charge |
| WigglyDoubleBondFixer | A descendant of AbstractStructureFixer which sets wiggly bond to crossed double bond |
| Annotation Types Summary | |
|---|---|
| Fixes | This annotation is used to annotate the StructureFixer implementations which
StructureCheckerErrorType can be fixed by the current fixer |
| FixesExternal | This annotation is used to annotate the StructureFixer implementations which
error codes (identified by a unqie String) can be fixed by the current fixer |
Structure fixers can be used to fix problems identified by structure checker instances.
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