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Uses of JniInchiException in net.sf.jniinchi |
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Subclasses of JniInchiException in net.sf.jniinchi | |
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class |
LoadNativeLibraryException
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Methods in net.sf.jniinchi that throw JniInchiException | |
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static INCHI_STATUS |
JniInchiWrapper.checkInchi(String inchi,
boolean strict)
Checks if the string represents valid InChI/standard InChI. |
static INCHI_KEY_STATUS |
JniInchiWrapper.checkInchiKey(String key)
Checks whether a string represents valid InChIKey. |
protected static String |
JniInchiWrapper.checkOptions(List<INCHI_OPTION> ops)
Checks and canonicalises options. |
protected static String |
JniInchiWrapper.checkOptions(String ops)
Checks and canonicalises options. |
static JniInchiOutput |
JniInchiWrapper.getInchi(JniInchiInput input)
Generates the InChI for a chemical structure. |
static JniInchiOutput |
JniInchiWrapper.getInchiFromInchi(JniInchiInputInchi input)
Converts an InChI into an InChI for validation purposes (the same as the -InChI2InChI option). |
static JniInchiOutputKey |
JniInchiWrapper.getInchiKey(String inchi)
Calculates the InChIKey for an InChI string. |
static JniInchiInputData |
JniInchiWrapper.getInputFromAuxInfo(String auxInfo)
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static JniInchiOutput |
JniInchiWrapper.getStdInchi(JniInchiInput input)
Calculates the Standard InChI string for a chemical structure. |
static JniInchiOutputStructure |
JniInchiWrapper.getStructureFromInchi(JniInchiInputInchi input)
Generated 0D structure from an InChI string. |
static void |
Main.runChecks()
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Constructors in net.sf.jniinchi that throw JniInchiException | |
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JniInchiInput(JniInchiStructure struct,
String opts)
Constructor. |
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JniInchiInput(List opts)
Constructor. |
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JniInchiInput(String opts)
Constructor. |
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JniInchiInputInchi(String inchi,
List opts)
Constructor. |
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JniInchiInputInchi(String inchi,
String opts)
Constructor. |
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JniInchiOutputKey(INCHI_KEY retStatus,
String key)
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JniInchiOutputKey(int ret,
String key)
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