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java.lang.Objectchemaxon.checkers.AbstractStructureChecker
chemaxon.checkers.ComponentChecker<E>
E
- is the type of the component (for example: MolAtom, MolBond, etc...)public abstract class ComponentChecker<E>
Descendants of the abstract ComponentChecker class implement detect problems related to disconnected components (fragments).
Field Summary |
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Fields inherited from class chemaxon.checkers.AbstractStructureChecker |
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errorType, propertyChangeSupport |
Fields inherited from interface chemaxon.checkers.StructureChecker |
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PROPERTY_KEY_VALID |
Constructor Summary | |
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ComponentChecker(StructureCheckerErrorType errorType)
Constructor to create a Structure checker instance with the given errorType. |
Method Summary | |
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protected abstract boolean |
check(Molecule molecule,
E component)
Checks if the component with index i has problem |
protected StructureCheckerResult |
check1(Molecule molecule)
Iterates through the components and checks every component. |
protected abstract StructureCheckerResult |
createResult(Molecule molecule,
java.util.List<E> componentList)
Creates a StructureCheckerResult from a List containing the components. |
protected abstract E |
getComponent(Molecule molecule,
int i)
Gets the component from the molecule with index i. |
protected abstract int |
getComponentCount(Molecule molecule)
Gets the number of the components in the molecule |
protected void |
initialize()
Empty default implementation |
Methods inherited from class java.lang.Object |
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finalize, getClass, notify, notifyAll, wait, wait, wait |
Constructor Detail |
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public ComponentChecker(StructureCheckerErrorType errorType)
errorType
- element of StructureCheckerErrorType
Method Detail |
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protected abstract int getComponentCount(Molecule molecule)
molecule
- the molecule to check
protected abstract E getComponent(Molecule molecule, int i)
molecule
- the molecule to checki
- the index of the component
protected void initialize()
protected StructureCheckerResult check1(Molecule molecule)
List
. After the iteration if no problem occurred
the result is null otherwise the method creates a StructureCheckerResult
containing the atoms and bonds of the problematic components.
check1
in class AbstractStructureChecker
molecule
- the Molecule
instance to be checked for problems
StructureCheckerResult
which contains all the indices of the problematic componentsprotected abstract StructureCheckerResult createResult(Molecule molecule, java.util.List<E> componentList)
StructureCheckerResult
from a List
containing the components.
molecule
- is a Molecule
instancecomponentList
- is an instance of List
containing the problematic components
StructureCheckerResult
containing all problematic component indicesprotected abstract boolean check(Molecule molecule, E component)
molecule
- is a Molecule
instancecomponent
- the current component to check
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