addLossFormula(const EmpiricalFormula &) | Residue | |
addLossName(const String &name) | Residue | |
addNTermLossFormula(const EmpiricalFormula &) | Residue | |
addNTermLossName(const String &name) | Residue | |
addResidueSet(const String &residue_sets) | Residue | |
addSynonym(const String &synonym) | Residue | |
AIon enum value | Residue | |
average_weight_ | Residue | protected |
BIon enum value | Residue | |
BIonMinusH20 enum value | Residue | |
BIonMinusNH3 enum value | Residue | |
CIon enum value | Residue | |
CTerminal enum value | Residue | |
formula_ | Residue | protected |
Full enum value | Residue | |
gb_bb_l_ | Residue | protected |
gb_bb_r_ | Residue | protected |
gb_sc_ | Residue | protected |
getAverageWeight(ResidueType res_type=Full) const | Residue | |
getBackboneBasicityLeft() const | Residue | |
getBackboneBasicityRight() const | Residue | |
getFormula(ResidueType res_type=Full) const | Residue | |
getInternalToAIon() | Residue | inlinestatic |
getInternalToBIon() | Residue | inlinestatic |
getInternalToCIon() | Residue | inlinestatic |
getInternalToCTerm() | Residue | inlinestatic |
getInternalToFull() | Residue | inlinestatic |
getInternalToNTerm() | Residue | inlinestatic |
getInternalToXIon() | Residue | inlinestatic |
getInternalToYIon() | Residue | inlinestatic |
getInternalToZIon() | Residue | inlinestatic |
getInternalToZp1Ion() | Residue | inlinestatic |
getInternalToZp2Ion() | Residue | inlinestatic |
getLossFormulas() const | Residue | |
getLossNames() const | Residue | |
getLowMassIons() const | Residue | |
getModification() const | Residue | |
getModificationName() const | Residue | |
getMonoWeight(ResidueType res_type=Full) const | Residue | |
getName() const | Residue | |
getNTermLossFormulas() const | Residue | |
getNTermLossNames() const | Residue | |
getOneLetterCode() const | Residue | |
getPiValue() const | Residue | |
getPka() const | Residue | |
getPkb() const | Residue | |
getPkc() const | Residue | |
getResidueSets() const | Residue | |
getResidueTypeName(const ResidueType res_type) | Residue | static |
getSideChainBasicity() const | Residue | |
getSynonyms() const | Residue | |
getThreeLetterCode() const | Residue | |
hasNeutralLoss() const | Residue | |
hasNTermNeutralLosses() const | Residue | |
Internal enum value | Residue | |
internal_formula_ | Residue | protected |
internal_to_a_monoweight_ | Residue | protectedstatic |
internal_to_b_monoweight_ | Residue | protectedstatic |
internal_to_c_monoweight_ | Residue | protectedstatic |
internal_to_cterm_monoweight_ | Residue | protectedstatic |
internal_to_full_monoweight_ | Residue | protectedstatic |
internal_to_nterm_monoweight_ | Residue | protectedstatic |
internal_to_x_monoweight_ | Residue | protectedstatic |
internal_to_y_monoweight_ | Residue | protectedstatic |
internal_to_z_monoweight_ | Residue | protectedstatic |
internal_to_zp1_monoweight_ | Residue | protectedstatic |
internal_to_zp2_monoweight_ | Residue | protectedstatic |
isInResidueSet(const String &residue_set) | Residue | |
isModified() const | Residue | |
loss_formulas_ | Residue | protected |
loss_names_ | Residue | protected |
low_mass_ions_ | Residue | protected |
modification_ | Residue | protected |
mono_weight_ | Residue | protected |
name_ | Residue | protected |
names_of_residuetype | Residue | inlinestatic |
NonIdentified enum value | Residue | |
NTerm_loss_formulas_ | Residue | protected |
NTerm_loss_names_ | Residue | protected |
NTerminal enum value | Residue | |
one_letter_code_ | Residue | protected |
operator!=(const Residue &residue) const | Residue | |
operator!=(char one_letter_code) const | Residue | |
operator<<(std::ostream &os, const Residue &residue) | Residue | friend |
operator=(const Residue &)=default | Residue | |
operator=(Residue &&) &=default | Residue | |
operator==(const Residue &residue) const | Residue | |
operator==(char one_letter_code) const | Residue | |
pka_ | Residue | protected |
pkb_ | Residue | protected |
pkc_ | Residue | protected |
Precursor enum value | Residue | |
Residue() | Residue | |
Residue(const Residue &)=default | Residue | |
Residue(Residue &&)=default | Residue | |
Residue(const String &name, const String &three_letter_code, const String &one_letter_code, const EmpiricalFormula &formula, double pka=0, double pkb=0, double pkc=-1, double gb_sc=0, double gb_bb_l=0, double gb_bb_r=0, const std::set< String > &synonyms=std::set< String >()) | Residue | |
residue_sets_ | Residue | protected |
ResidueDB class | Residue | friend |
ResidueType enum name | Residue | |
residueTypeToIonLetter(const ResidueType &res_type) | Residue | static |
setAverageWeight(double weight) | Residue | |
setBackboneBasicityLeft(double gb_bb_l) | Residue | |
setBackboneBasicityRight(double gb_bb_r) | Residue | |
setFormula(const EmpiricalFormula &formula) | Residue | |
setLossFormulas(const std::vector< EmpiricalFormula > &) | Residue | |
setLossNames(const std::vector< String > &name) | Residue | |
setLowMassIons(const std::vector< EmpiricalFormula > &low_mass_ions) | Residue | |
setModification(const String &name) | Residue | |
setModification(const ResidueModification *mod) | Residue | |
setModification(const ResidueModification &mod) | Residue | |
setModificationByDiffMonoMass(double diffMonoMass) | Residue | |
setMonoWeight(double weight) | Residue | |
setName(const String &name) | Residue | |
setNTermLossFormulas(const std::vector< EmpiricalFormula > &) | Residue | |
setNTermLossNames(const std::vector< String > &name) | Residue | |
setOneLetterCode(const String &one_letter_code) | Residue | |
setPka(double value) | Residue | |
setPkb(double value) | Residue | |
setPkc(double value) | Residue | |
setResidueSets(const std::set< String > &residues_sets) | Residue | |
setSideChainBasicity(double gb_sc) | Residue | |
setSynonyms(const std::set< String > &synonyms) | Residue | |
setThreeLetterCode(const String &three_letter_code) | Residue | |
SizeOfResidueType enum value | Residue | |
synonyms_ | Residue | protected |
three_letter_code_ | Residue | protected |
toString() const | Residue | |
Unannotated enum value | Residue | |
XIon enum value | Residue | |
YIon enum value | Residue | |
YIonMinusH20 enum value | Residue | |
YIonMinusNH3 enum value | Residue | |
ZIon enum value | Residue | |
Zp1Ion enum value | Residue | |
Zp2Ion enum value | Residue | |
~Residue() | Residue | virtual |