Element

class pyopenms.Element

Bases: object

Cython implementation of _Element

Documentation is available at http://www.openms.de/current_doxygen/html/classOpenMS_1_1Element.html

__init__()

• Cython signature: void Element()

• Cython signature: void Element(Element &)

• Cython signature: void Element(String name, String symbol, unsigned int atomic_number, double average_weight, double mono_weight, IsotopeDistribution isotopes)

Methods

__init__	Cython signature: void Element()
getAtomicNumber	Cython signature: unsigned int getAtomicNumber() Returns the unique atomic number
getAverageWeight	Cython signature: double getAverageWeight() Returns the average weight of the element
getIsotopeDistribution	Cython signature: IsotopeDistribution getIsotopeDistribution() Returns the isotope distribution of the element
getMonoWeight	Cython signature: double getMonoWeight() Returns the mono isotopic weight of the element
getName	Cython signature: String getName() Returns the name of the element
getSymbol	Cython signature: String getSymbol() Returns symbol of the element
setAtomicNumber	Cython signature: void setAtomicNumber(unsigned int atomic_number) Sets unique atomic number
setAverageWeight	Cython signature: void setAverageWeight(double weight) Sets the average weight of the element
setIsotopeDistribution	Cython signature: void setIsotopeDistribution(IsotopeDistribution isotopes) Sets the isotope distribution of the element
setMonoWeight	Cython signature: void setMonoWeight(double weight) Sets the mono isotopic weight of the element
setName	Cython signature: void setName(String name) Sets the name of the element
setSymbol	Cython signature: void setSymbol(String symbol) Sets symbol of the element

getAtomicNumber()

Cython signature: unsigned int getAtomicNumber() Returns the unique atomic number

getAverageWeight()

Cython signature: double getAverageWeight() Returns the average weight of the element

getIsotopeDistribution()

Cython signature: IsotopeDistribution getIsotopeDistribution() Returns the isotope distribution of the element

getMonoWeight()

Cython signature: double getMonoWeight() Returns the mono isotopic weight of the element

getName()

Cython signature: String getName() Returns the name of the element

getSymbol()

Cython signature: String getSymbol() Returns symbol of the element

setAtomicNumber()

Cython signature: void setAtomicNumber(unsigned int atomic_number) Sets unique atomic number

setAverageWeight()

Cython signature: void setAverageWeight(double weight) Sets the average weight of the element

setIsotopeDistribution()

Cython signature: void setIsotopeDistribution(IsotopeDistribution isotopes) Sets the isotope distribution of the element

setMonoWeight()

Cython signature: void setMonoWeight(double weight) Sets the mono isotopic weight of the element

setName()

Cython signature: void setName(String name) Sets the name of the element

setSymbol()

Cython signature: void setSymbol(String symbol) Sets symbol of the element