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Searched defs:getIsotope (Results 1 – 8 of 8) sorted by relevance

/dports/science/cdk/cdk-cdk-2.3/tool/formula/src/main/java/org/openscience/cdk/formula/
H A DIsotopePattern.java76 public IsotopeContainer getIsotope(int position) { in getIsotope() method in IsotopePattern
H A DMolecularFormulaRange.java149 private IIsotope getIsotope(IIsotope isotope) { in getIsotope() method in MolecularFormulaRange
/dports/science/cdk/cdk-cdk-2.3/base/core/src/main/java/org/openscience/cdk/config/
H A DIsotopeFactory.java152 public IIsotope getIsotope(String symbol, int massNumber) { in getIsotope() method in IsotopeFactory
173 public IIsotope getIsotope(String symbol, double exactMass, double tolerance) { in getIsotope() method in IsotopeFactory
/dports/science/opsin/dan2097-opsin-9b25f7546b67/opsin-core/src/main/java/uk/ac/cam/ch/wwmm/opsin/
H A DIsotopeSpecificationParser.java28 int getIsotope() { in getIsotope() method in IsotopeSpecificationParser.IsotopeSpecification
H A DAtom.java383 Integer getIsotope() { in getIsotope() method in Atom
/dports/science/cdk/cdk-cdk-2.3/base/data/src/main/java/org/openscience/cdk/formula/
H A DMolecularFormula.java193 private IIsotope getIsotope(IIsotope isotope) { in getIsotope() method in MolecularFormula
/dports/science/cdk/cdk-cdk-2.3/base/silent/src/main/java/org/openscience/cdk/silent/
H A DMolecularFormula.java190 private IIsotope getIsotope(IIsotope isotope) { in getIsotope() method in MolecularFormula
/dports/science/rdkit/rdkit-Release_2021_03_5/Code/GraphMol/
H A DAtom.h231 unsigned int getIsotope() const { return d_isotope; }; in getIsotope() function