Package org.jmol.api

Interface JmolJDXMOLReader

All Known Implementing Classes:

JcampdxReader

public interface JmolJDXMOLReader

Method Summary

Modifier and Type	Method	Description
void	addPeakData(String info)
String	discardLinesUntilContains(String string)
String	discardLinesUntilContains2(String tag1, String tag2)
String	discardLinesUntilNonBlank()
void	processModelData(String data, String id, String type, String base, String last, float modelScale, float vibScale, boolean isFirst)
String	rd()
void	setSpectrumPeaks(int nH, String piUnitsX, String piUnitsY)

Method Detail

addPeakData

void addPeakData(String info)

discardLinesUntilContains2

String discardLinesUntilContains2(String tag1,
                                  String tag2)
                           throws Exception

Throws:

Exception

discardLinesUntilContains

String discardLinesUntilContains(String string)
                          throws Exception

Throws:

Exception

discardLinesUntilNonBlank

String discardLinesUntilNonBlank()
                          throws Exception

Throws:

Exception

processModelData

void processModelData(String data,
                      String id,
                      String type,
                      String base,
                      String last,
                      float modelScale,
                      float vibScale,
                      boolean isFirst)
               throws Exception

Throws:

Exception

rd

String rd()
   throws Exception

Throws:

Exception

setSpectrumPeaks

void setSpectrumPeaks(int nH,
                      String piUnitsX,
                      String piUnitsY)