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The Octet Molecular Representation Framework v0.8.2 | |||||||||
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java.lang.Objectnet.sf.octet.builder.AbstractRepresentationBuilder.AtomTemplate
A template for the construction of represenation-specific atoms. Note that this class is not immutable; values returned may differ from those returned by previous or subsequent method invocations.
| Method Summary | |
int |
countImplicitHydrogens()
Returns the number of implicit hydrogens associated with this
AtomTemplate. |
int |
countOrbitalTemplates()
Returns the number of OrbitalTemplates owned by this
AtomTemplate. |
Atom |
getAtom()
Returns the Atom owned by this AtomTemplate. |
AbstractRepresentationBuilder.ConfigurationTemplate |
getConfigurationTemplate()
Returns the ConfigurationTemplate owned by this
AtomTemplate. |
int |
getElectronCount()
Returns the number of electrons owned by this AtomTemplate. |
AbstractRepresentationBuilder.OrbitalTemplate |
getOrbitalTemplate(int index)
Returns the OrbitalTemplate at the specified index. |
| Methods inherited from class java.lang.Object |
clone, equals, finalize, getClass, hashCode, notify, notifyAll, toString, wait, wait, wait |
| Method Detail |
public Atom getAtom()
Atom owned by this AtomTemplate.
Atom owned by this AtomTemplatepublic int getElectronCount()
AtomTemplate.
AtomTemplatepublic int countOrbitalTemplates()
OrbitalTemplates owned by this
AtomTemplate.
OrbitalTemplates owned by this
AtomTemplatepublic AbstractRepresentationBuilder.OrbitalTemplate getOrbitalTemplate(int index)
OrbitalTemplate at the specified index.
index - the index to address
OrbitalTemplate at the specified indexpublic AbstractRepresentationBuilder.ConfigurationTemplate getConfigurationTemplate()
ConfigurationTemplate owned by this
AtomTemplate.
ConfigurationTemplate owned by this
AtomTemplatepublic int countImplicitHydrogens()
AtomTemplate.
AtomTemplate
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The Octet Molecular Representation Framework v0.8.2 | |||||||||
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