Метод | Описание | |
---|---|---|
GetMolecularFormula ( IAtomContainer atomContainer ) : IMolecularFormula | ||
GetMonoisotopicMass ( IMolecularFormula formula ) : double | ||
GetMonoisotopicMass ( string formula ) : double | ||
GetString ( IMolecularFormula formula ) : string | ||
IsPossibleNeutralLoss ( double>.Dictionary |
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ParseFormula ( IMolecularFormula formula ) : double>.Dictionary |
Метод | Описание | |
---|---|---|
ParseFormula ( string formula ) : double>.Dictionary |
public static GetMolecularFormula ( IAtomContainer atomContainer ) : IMolecularFormula | ||
atomContainer | IAtomContainer | |
Результат | IMolecularFormula |
public static GetMonoisotopicMass ( IMolecularFormula formula ) : double | ||
formula | IMolecularFormula | |
Результат | double |
public static GetMonoisotopicMass ( string formula ) : double | ||
formula | string | |
Результат | double |
public static GetString ( IMolecularFormula formula ) : string | ||
formula | IMolecularFormula | |
Результат | string |
public static IsPossibleNeutralLoss ( double>.Dictionary |
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originalFormulaMap | double>.Dictionary | |
neutralLossFormula | IMolecularFormula | |
Результат | bool |
public static ParseFormula ( IMolecularFormula formula ) : double>.Dictionary |
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formula | IMolecularFormula | |
Результат | double>.Dictionary |