org.jmol.modelset
Class Molecule
java.lang.Object
org.jmol.modelset.Molecule
class Molecule
- extends java.lang.Object
Constructor Summary |
Molecule(ModelSet modelSet,
int moleculeIndex,
java.util.BitSet atomList,
int modelIndex,
int indexInModel)
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Methods inherited from class java.lang.Object |
clone, equals, finalize, getClass, hashCode, notify, notifyAll, toString, wait, wait, wait |
modelSet
ModelSet modelSet
moleculeIndex
int moleculeIndex
modelIndex
int modelIndex
indexInModel
int indexInModel
nAtoms
int nAtoms
nElements
int nElements
elementCounts
int[] elementCounts
altElementCounts
int[] altElementCounts
elementNumberMax
int elementNumberMax
altElementMax
int altElementMax
mf
java.lang.String mf
atomList
java.util.BitSet atomList
Molecule
Molecule(ModelSet modelSet,
int moleculeIndex,
java.util.BitSet atomList,
int modelIndex,
int indexInModel)
getElementAndAtomCount
void getElementAndAtomCount(java.util.BitSet atomList)
getMolecularFormula
java.lang.String getMolecularFormula()
getInfo
java.util.Hashtable getInfo()