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Packages that use Atom | |
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starfish.chemistry |
Uses of Atom in starfish.chemistry |
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Fields in starfish.chemistry declared as Atom | |
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Atom |
SpatialSet.atom
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Atom[] |
DistanceConstraint.atom1
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Atom[] |
DistanceConstraint.atom2
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Atom[] |
MoleculePrimitives.atoms
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Atom |
Bond.begin
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Atom |
Bond.end
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Atom |
Entity.firstAtom
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Atom |
Entity.lastAtom
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Atom |
DistanceConstraint.next
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Atom |
Atom.next
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Atom |
Atom.parent
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Atom |
DistanceConstraint.previous
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Atom |
Atom.previous
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Atom |
Atom.rotGroup
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Atom |
Atom.rotUnit
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Methods in starfish.chemistry that return Atom | |
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Atom |
SpatialSetGroup.getAnAtom()
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static Atom |
Molecule.getAtom(tcl.lang.Interp interp,
MolFilter molFilter)
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Atom |
Residue.getAtom(java.lang.String name)
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Atom |
Compound.getAtom(java.lang.String name)
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static Atom |
Molecule.getAtomByName(tcl.lang.Interp interp,
java.lang.String name)
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static Atom[][] |
NoeCmd.getAtoms(tcl.lang.Interp interp,
starfish.datasets.peaks.Peak peak)
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Atom |
Entity.getFirstAtom()
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Atom |
Atom.getParent()
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Atom[] |
Atom.getPartners(int targetANum,
int shells)
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Atom[] |
Residue.getPseudo(java.lang.String pseudoName)
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static Atom |
Molecule.getStartAtom(Molecule molecule)
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Methods in starfish.chemistry that return types with arguments of type Atom | |
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java.util.ArrayList<Atom> |
Compound.getAtoms(java.lang.String match)
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java.util.ArrayList<Atom> |
Molecule.getAttachedHydrogens(Atom atom)
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Methods in starfish.chemistry with parameters of type Atom | |
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void |
Residue.addAtom(Atom atom)
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void |
Compound.addAtom(Atom atom)
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static int |
Atom.addBond(Atom atom1,
Atom atom2,
int order)
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static int |
Atom.addBond(Atom atom1,
Atom atom2,
int order,
int stereo)
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static int |
Molecule.buildTree(tcl.lang.Interp interp,
Molecule molecule,
Atom startAtom,
java.util.Vector atomList,
MTree mTree)
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static int |
Atom.calcBond(Atom atom1,
Atom atom2,
int order)
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static int |
Atom.calcBond(Atom atom1,
Atom atom2,
int order,
int stereo)
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static int |
AtomUtil.checkPattern(tcl.lang.Interp interp,
Atom[] atoms,
java.lang.String[] pattern,
java.lang.String[] relation)
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int |
Molecule.getAtoms(int iStructure,
Atom[] atoms)
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java.util.ArrayList<Atom> |
Molecule.getAttachedHydrogens(Atom atom)
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void |
Atom.removeBondTo(Atom atom)
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void |
PPMv.setValid(boolean valid,
Atom atom)
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Constructors in starfish.chemistry with parameters of type Atom | |
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Bond(Atom begin,
Atom end)
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DistanceConstraint(starfish.datasets.peaks.Peak p,
Atom a1,
Atom a2,
double newScale)
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SpatialSet(java.lang.String name,
Atom atom)
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SpatialSetGroup(Atom[] atoms)
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