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Packages that use SmiLibIOException | |
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de.modlab.smilib.fragments | |
de.modlab.smilib.io | |
de.modlab.smilib.iterator |
Uses of SmiLibIOException in de.modlab.smilib.fragments |
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Constructors in de.modlab.smilib.fragments that throw SmiLibIOException | |
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ComponentAdministrator(java.lang.String[] scaffolds,
java.lang.String[] linkers,
java.lang.String[] buildingBlocks,
boolean checkSmiles)
Creates a new instance of ComponentAdministrator, used when SMiLib ist started in GUI mode. |
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ComponentAdministrator(java.lang.String scaffoldsPath,
java.lang.String linkersPath,
java.lang.String buildingBlocksPath,
boolean checkSmiles)
Creates a new instance of ComponentAdministrator. |
Uses of SmiLibIOException in de.modlab.smilib.io |
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Methods in de.modlab.smilib.io that throw SmiLibIOException | |
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void |
SmilesFileWriter.close()
Closes the SmilesWriter. |
void |
SmilesGuiWriter.close()
Closes the SmilesWriter. |
void |
SmilesLineWriter.close()
Closes the SmilesWriter. |
void |
SmilesListWriter.close()
Closes the SmilesWriter. |
void |
SmilesToSDFWriter.close()
Closes the SmilesWriter. |
void |
SmilesWriter.close()
Closes the SmilesWriter. |
java.util.List<E> |
SmilesFileReader.readSmiles(java.lang.String path)
Reads SMILES from source files. |
java.util.List<E> |
SmilesReader.readSmiles(java.lang.String path)
Reads SMILES from a source file. |
void |
SmilesFileWriter.writeSMILES(java.lang.StringBuilder smiles,
java.lang.StringBuilder id)
Writes a SMILES string. |
void |
SmilesGuiWriter.writeSMILES(java.lang.StringBuilder smiles,
java.lang.StringBuilder id)
Writes a SMILES string. |
void |
SmilesLineWriter.writeSMILES(java.lang.StringBuilder smiles,
java.lang.StringBuilder id)
Writes a SMILES string. |
void |
SmilesListWriter.writeSMILES(java.lang.StringBuilder smiles,
java.lang.StringBuilder id)
Writes a SMILES string. |
void |
SmilesToSDFWriter.writeSMILES(java.lang.StringBuilder smiles,
java.lang.StringBuilder id)
Writes a SMILES string. |
void |
SmilesWriter.writeSMILES(java.lang.StringBuilder smiles,
java.lang.StringBuilder id)
Writes a SMILES string. |
Uses of SmiLibIOException in de.modlab.smilib.iterator |
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Constructors in de.modlab.smilib.iterator that throw SmiLibIOException | |
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PartialCombinationIterator(java.lang.String rSchemePath,
int[] numsRGroups,
int maxLinkers,
int maxBBlocks)
Creates a new instance of PartialCombinationIterator |
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