Package org.jmol.api
Interface JmolJDXMOLReader
- All Known Implementing Classes:
JcampdxReader
public interface JmolJDXMOLReader
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Method Summary
Modifier and TypeMethodDescriptionvoid
addPeakData
(String info) discardLinesUntilContains
(String string) discardLinesUntilContains2
(String tag1, String tag2) void
processModelData
(String data, String id, String type, String base, String last, float modelScale, float vibScale, boolean isFirst) rd()
void
setSpectrumPeaks
(int nH, String piUnitsX, String piUnitsY)
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Method Details
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addPeakData
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discardLinesUntilContains2
- Throws:
Exception
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discardLinesUntilContains
- Throws:
Exception
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discardLinesUntilNonBlank
- Throws:
Exception
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processModelData
void processModelData(String data, String id, String type, String base, String last, float modelScale, float vibScale, boolean isFirst) throws Exception - Throws:
Exception
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rd
- Throws:
Exception
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setSpectrumPeaks
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