Class pmr.molecule.SimpleSMILES
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Class pmr.molecule.SimpleSMILES
java.lang.Object
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+----pmr.simplegraph.DrawableObject
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+----pmr.molecule.SimpleSMILES
- public class SimpleSMILES
- extends DrawableObject
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SimpleSMILES(String)
- create from a SMILES String
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debug()
-
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getMolecularWeight()
-
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hydrogenCount()
-
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main(String[])
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process()
- complex objects may require processing; override this
SimpleSMILES
public SimpleSMILES(String s)
- create from a SMILES String
process
public void process()
- complex objects may require processing; override this
- Overrides:
- process in class DrawableObject
hydrogenCount
public int hydrogenCount()
getMolecularWeight
public double getMolecularWeight()
debug
public void debug()
- Overrides:
- debug in class DrawableObject
main
public static void main(String args[])
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