Package net.sf.jniinchi
Class JniInchiInputInchi
java.lang.Object
net.sf.jniinchi.JniInchiInputInchi
Encapsulates input for InChI to structure conversion.
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Field Summary
Fields -
Constructor Summary
ConstructorsConstructorDescriptionJniInchiInputInchi
(String inchi) Constructor.JniInchiInputInchi
(String inchi, String opts) Constructor.JniInchiInputInchi
(String inchi, List<INCHI_OPTION> opts) Constructor. -
Method Summary
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Field Details
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inchiString
InChI ASCIIZ string to be converted to a strucure -
options
InChI options: space-delimited
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Constructor Details
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JniInchiInputInchi
Constructor.- Parameters:
inchi
- InChI string
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JniInchiInputInchi
Constructor.- Parameters:
inchi
- InChI stringopts
- Options- Throws:
JniInchiException
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JniInchiInputInchi
Constructor.- Parameters:
inchi
- InChI stringopts
- Options- Throws:
JniInchiException
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Method Details
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getOptions
Returns options string.- Returns:
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getInchi
Returns options string.- Returns:
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