Package org.openscience.cdk.libio.cml
Class QSARCustomizer
- java.lang.Object
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- org.openscience.cdk.libio.cml.QSARCustomizer
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- All Implemented Interfaces:
ICMLCustomizer
public class QSARCustomizer extends Object implements ICMLCustomizer
Customizer for the libio-cml Convertor to be able to export details for QSAR descriptors calculated for Molecules.- Author:
- egonw
- Source code:
- main
- Belongs to CDK module:
- qsarcml
- Created on:
- 2005-05-04
- Requires:
- java1.5+
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Constructor Summary
Constructors Constructor Description QSARCustomizer()
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Method Summary
All Methods Instance Methods Concrete Methods Modifier and Type Method Description voidcustomize(IAtomContainer molecule, Object nodeToAdd)voidcustomize(IAtom atom, Object nodeToAdd)voidcustomize(IBond bond, Object nodeToAdd)
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Method Detail
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customize
public void customize(IBond bond, Object nodeToAdd) throws Exception
- Specified by:
customizein interfaceICMLCustomizer- Throws:
Exception
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customize
public void customize(IAtom atom, Object nodeToAdd) throws Exception
- Specified by:
customizein interfaceICMLCustomizer- Throws:
Exception
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customize
public void customize(IAtomContainer molecule, Object nodeToAdd) throws Exception
- Specified by:
customizein interfaceICMLCustomizer- Throws:
Exception
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