| Modifier and Type | Method and Description |
|---|---|
Composition |
CompositionReader.read(org.apache.avro.io.Decoder in) |
| Modifier and Type | Method and Description |
|---|---|
void |
CompositionWriter.write(Composition composition,
org.apache.avro.io.Encoder out) |
| Modifier and Type | Method and Description |
|---|---|
Composition |
Composition.Builder.build()
Build the composition
|
static Composition |
Composition.parseComposition(String s)
Creates a Composition by parsing the given string.
|
static Composition |
Composition.subtractCompositions(Composition composition1,
Composition composition2) |
| Modifier and Type | Method and Description |
|---|---|
Composition.Builder |
Composition.Builder.addAll(Composition composition)
Add all of the atoms in
composition to this |
static double |
MassCalculator.calcIsotopeDelta(Composition composition) |
static double |
MassCalculator.calculateAverageMass(Composition composition)
Calculates the sum of the average mass of each Atom in this
Composition.
|
static Composition |
Composition.subtractCompositions(Composition composition1,
Composition composition2) |
| Constructor and Description |
|---|
Composition(Composition... compositions)
Constructs a composition that is the sum of the
compositions |
| Modifier and Type | Method and Description |
|---|---|
com.google.common.base.Optional<Composition> |
GlycoCtResolver.getLinkageComposition(String glycoCtCode) |
com.google.common.base.Optional<Composition> |
DefaultGlycoCtResolver.getLinkageComposition(String glycoCtCode)
Returns the appropriate LinkageComposition instance for the given GlycoCT code.
|
| Modifier and Type | Field and Description |
|---|---|
protected Composition |
GlycanNode.composition |
| Modifier and Type | Method and Description |
|---|---|
Composition |
GlycanNode.getComposition()
Return the composition of the GlycanNode
|
Composition |
GlycanFragment.getEndComposition()
Return the composition of the end of the glycan.
|
Composition |
Glycan.getEndComposition()
Return the composition of the end of the glycan.
|
Composition |
GlycanMassCalculator.getGlycosidicDeltaComposition(IonType ionType)
Return the composition that the glycan have lost during the glycosidic fragmentation depending on the ion type.
|
Composition |
DefaultGlycanMassCalculator.getGlycosidicDeltaComposition(IonType ionType)
Return the value of mass that the glycan have lost during the glycosidic fragmentation depending on the ion type.
|
| Modifier and Type | Method and Description |
|---|---|
com.google.common.base.Optional<Composition> |
GlycosidicLinkage.getAnomericComposition() |
com.google.common.base.Optional<Composition> |
Linkage.getLinkedComposition()
Return the composition of the linkage.
|
com.google.common.base.Optional<Composition> |
SubstituentLinkage.getLinkedComposition() |
com.google.common.base.Optional<Composition> |
GlycosidicLinkage.getLinkedComposition() |
| Modifier and Type | Method and Description |
|---|---|
Monosaccharide |
GlycanFragment.Builder.setCleavedRoot(Monosaccharide root,
FragmentType fragmentType,
Composition endComposition,
CutIndexes cutIndexes)
Set the cleaved root of the Glycan Fragments.
|
Monosaccharide |
GlycanFragment.Builder.setRoot(Monosaccharide root,
FragmentType fragmentType,
Composition endComposition)
Set the root of the Glycan Fragments.
|
Monosaccharide |
Glycan.Builder.setRoot(Monosaccharide monosaccharide,
com.google.common.base.Optional<Anomericity> endAnomericity,
String databaseIdentifier,
Composition endComposition)
Set the root of the Glycan.
|
| Constructor and Description |
|---|
Glycan(Monosaccharide root,
com.google.common.base.Optional<Anomericity> reducingEndAnomericity,
String databaseIdentifier,
Composition endComposition) |
GlycanFragment(Monosaccharide root,
FragmentType fragmentType,
Composition endComposition) |
GlycanFragment(Monosaccharide root,
FragmentType fragmentType,
List<GlycanNode> nodes,
List<SEdge> edges,
org.expasy.mzjava.glycomics.mol.IdentityEdgeMultimap<Monosaccharide,Monosaccharide,org.expasy.mzjava.glycomics.mol.GlycosidicEdge> monosaccharideEdgeMultimap,
org.expasy.mzjava.glycomics.mol.IdentityEdgeMultimap<Monosaccharide,Substituent,org.expasy.mzjava.glycomics.mol.SubstituentEdge> substituentEdgeMultimap,
Composition endComposition,
Map<CleavedMonosaccharide,IonType> monosaccharideIonTypeMap,
Map<SEdge,IonType> edgeIonTypeMap) |
GlycanNode(String name,
Composition composition) |
GlycosidicLinkage(Anomericity anomericity,
Integer anomericCarbon,
Integer linkedCarbon,
Composition anomericComposition,
Composition linkedComposition) |
Monosaccharide(String name,
Composition composition,
MonosaccharideSuperclass monosaccharideSuperclass,
MonosaccharideClass monosaccharideClass,
RingType ring,
int firstCarbonRing,
int lastCarbonRing) |
Substituent(String name,
Composition composition) |
SubstituentLinkage(Integer linkedCarbon,
Composition linkedComposition) |
| Constructor and Description |
|---|
GlycosidicLinkage(com.google.common.base.Optional<Anomericity> anomericity,
com.google.common.base.Optional<Integer> anomericCarbon,
com.google.common.base.Optional<Integer> linkedCarbon,
com.google.common.base.Optional<Composition> anomericComposition,
com.google.common.base.Optional<Composition> linkedComposition) |
GlycosidicLinkage(com.google.common.base.Optional<Anomericity> anomericity,
com.google.common.base.Optional<Integer> anomericCarbon,
com.google.common.base.Optional<Integer> linkedCarbon,
com.google.common.base.Optional<Composition> anomericComposition,
com.google.common.base.Optional<Composition> linkedComposition) |
SubstituentLinkage(com.google.common.base.Optional<Integer> linkedCarbon,
com.google.common.base.Optional<Composition> linkedComposition) |
| Modifier and Type | Field and Description |
|---|---|
static Composition |
GlycanFragAnnotation.EMPTY_COMPOSITION |
| Modifier and Type | Method and Description |
|---|---|
Composition |
GlycanFragAnnotation.getIsotopeComposition()
Return the Composition that contains the isotopes.
|
| Modifier and Type | Method and Description |
|---|---|
GlycanFragAnnotation.FragBuilder |
GlycanFragAnnotation.FragBuilder.addIsotopeComposition(Composition isotopeComposition)
Add all the atoms from
isotopeComposition |
| Constructor and Description |
|---|
GlycanFragAnnotation(int charge,
GlycanFragment fragment,
Composition isotopeComposition,
Mass neutralLoss) |
| Modifier and Type | Method and Description |
|---|---|
Composition |
AminoAcid.getCompositionOfMonomer()
Returns the composition of this amino acid when it is part of a polymer.
|
Composition |
AAMassCalculator.getDeltaComposition(IonType ionType) |
| Modifier and Type | Class and Description |
|---|---|
class |
NeutralLoss |
| Modifier and Type | Method and Description |
|---|---|
Composition |
UnimodMod.getComposition()
Returns the Composition associated with this UnimodMod.
|
| Modifier and Type | Field and Description |
|---|---|
static Composition |
PepFragAnnotation.EMPTY_COMPOSITION |
| Modifier and Type | Method and Description |
|---|---|
Composition |
PepFragAnnotation.getIsotopeComposition()
Return the Composition that contains the isotopes.
|
| Modifier and Type | Method and Description |
|---|---|
PepFragAnnotation.Builder |
PepFragAnnotation.Builder.addIsotopeComposition(Composition isotopeComposition)
Add all the atoms from
isotopeComposition |
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