com.epam.indigo

Class IndigoInchi

java.lang.Object

com.epam.indigo.IndigoInchi

public class IndigoInchi
extends Object

Constructor Summary

Constructors

Constructor and Description
IndigoInchi(Indigo indigo)

Method Summary

Modifier and Type	Method and Description
protected void	finalize()
String	getAuxInfo()
String	getInchi(IndigoObject molecule)
String	getInchi(IndigoObject molecule, String forceOptions)
String	getInchiKey(String inchi)
String	getLog()
String	getWarning()
IndigoObject	loadMolecule(String inchi)
void	resetOptions()
String	version()

Methods inherited from class java.lang.Object

clone, equals, getClass, hashCode, notify, notifyAll, toString, wait, wait, wait

Constructor Detail

IndigoInchi

public IndigoInchi(Indigo indigo)

Method Detail

finalize

protected void finalize()
                 throws Throwable

Overrides:

finalize in class Object

Throws:

Throwable

version

public String version()

resetOptions

public void resetOptions()

loadMolecule

public IndigoObject loadMolecule(String inchi)

getInchi

public String getInchi(IndigoObject molecule,
                       String forceOptions)

getInchi

public String getInchi(IndigoObject molecule)

getInchiKey

public String getInchiKey(String inchi)

getWarning

public String getWarning()

getLog

public String getLog()

getAuxInfo

public String getAuxInfo()