33 : m_precisionPtr(precision_ptr)
40 : m_precisionPtr(other.m_precisionPtr)
54 std::vector<std::pair<double, double>> exclusionMassMap;
56 std::sort(data_points.begin(),
62 for(
auto &data_point : data_points)
66 new_trace.push_back(data_point);
72 data_points = std::move(new_trace);
79 std::vector<std::pair<double, double>> &exclusionMassMap,
double mass)
const
81 for(
auto &mass_range : exclusionMassMap)
83 if((mass_range.first <= mass) && (mass_range.second >= mass))
93 std::vector<std::pair<double, double>> &exclusionMassMap,
double mass)
const
95 MzRange range1(mass + m_diffC12C13_z1, m_precisionPtr);
97 exclusionMassMap.push_back(
98 std::pair<double, double>(range1.
lower(), range1.
upper()));
101 MzRange range2(mass + m_diffC12C13_z2, m_precisionPtr);
103 exclusionMassMap.push_back(
104 std::pair<double, double>(range2.
lower(), range2.
upper()));
void addExclusionMap(std::vector< std::pair< double, double >> &exclusionMassMap, double mass) const
bool notExcluded(std::vector< std::pair< double, double >> &exclusionMassMap, double mass) const
Trace & filter(Trace &data_points) const override
virtual ~FilterRemoveC13()
FilterRemoveC13(PrecisionPtr precision_ptr)
pappso_double lower() const
pappso_double upper() const
A simple container of DataPoint instances.
sum peaks under a triangle base
tries to keep as much as possible monoisotopes, removing any possible C13 peaks and changes multichar...
const pappso_double DIFFC12C13(1.0033548378)