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# File 'lib/chemicalml/cml/base/atom.rb', line 7
def self.included(klass)
klass.class_eval do
include Chemicalml::Cml::Role::Atom
include Chemicalml::Cml::Base::CommonChildren
attribute :id, :string
attribute :element_type, :string
attribute :count, :string
attribute :formal_charge, :string
attribute :hydrogen_count, :string
attribute :isotope, :string
attribute :isotope_number, :string
attribute :spin_multiplicity, :string
attribute :title, :string
attribute :x2, :string
attribute :y2, :string
attribute :x3, :string
attribute :y3, :string
attribute :z3, :string
attribute :xFract, :string
attribute :yFract, :string
attribute :zFract, :string
attribute :atom_parity, :atomParity
attribute :atom_type, :atomType
attribute :electrons, :electron, collection: true
attribute :particles, :particle, collection: true
attribute :arrays, :array, collection: true
attribute :matrices, :matrix, collection: true
attribute :scalars, :scalar, collection: true
attribute :vectors3, :vector3, collection: true
attribute :convention, :string
attribute :dict_ref, :string
attribute :ref, :string
attribute :isotope_ref, :string
attribute :isotope_list_ref, :string
attribute :occupancy, :string
attribute :role, :string
attribute :space_group_multiplicity, :string
attribute :point_group_multiplicity, :string
xml do
namespace Chemicalml::Cml::Namespace
root 'atom'
map_attribute 'id', to: :id
map_attribute 'elementType', to: :element_type
map_attribute 'count', to: :count
map_attribute 'formalCharge', to: :formal_charge
map_attribute 'hydrogenCount', to: :hydrogen_count
map_attribute 'isotope', to: :isotope
map_attribute 'isotopeNumber', to: :isotope_number
map_attribute 'spinMultiplicity', to: :spin_multiplicity
map_attribute 'title', to: :title
map_attribute 'x2', to: :x2
map_attribute 'y2', to: :y2
map_attribute 'x3', to: :x3
map_attribute 'y3', to: :y3
map_attribute 'z3', to: :z3
map_attribute 'xFract', to: :xFract
map_attribute 'yFract', to: :yFract
map_attribute 'zFract', to: :zFract
map_element 'atomParity', to: :atom_parity
map_element 'atomType', to: :atom_type
map_element 'electron', to: :electrons
map_element 'particle', to: :particles
map_element 'array', to: :arrays
map_element 'matrix', to: :matrices
map_element 'scalar', to: :scalars
map_element 'vector3', to: :vectors3
map_attribute 'convention', to: :convention
map_attribute 'dictRef', to: :dict_ref
map_attribute 'ref', to: :ref
map_attribute 'isotopeRef', to: :isotope_ref
map_attribute 'isotopeListRef', to: :isotope_list_ref
map_attribute 'occupancy', to: :occupancy
map_attribute 'role', to: :role
map_attribute 'spaceGroupMultiplicity', to: :space_group_multiplicity
map_attribute 'pointGroupMultiplicity', to: :point_group_multiplicity
end
key_value do
map 'metadataList', to: :metadata_lists
map 'label', to: :labels
map 'name', to: :names
map 'description', to: :descriptions
map 'atomParity', to: :atom_parity
map 'atomType', to: :atom_type
map 'electron', to: :electrons
map 'particle', to: :particles
map 'array', to: :arrays
map 'matrix', to: :matrices
map 'scalar', to: :scalars
map 'vector3', to: :vectors3
map 'id', to: :id
map 'elementType', to: :element_type
map 'count', to: :count
map 'formalCharge', to: :formal_charge
map 'hydrogenCount', to: :hydrogen_count
map 'isotope', to: :isotope
map 'isotopeNumber', to: :isotope_number
map 'spinMultiplicity', to: :spin_multiplicity
map 'title', to: :title
map 'x2', to: :x2
map 'y2', to: :y2
map 'x3', to: :x3
map 'y3', to: :y3
map 'z3', to: :z3
map 'xFract', to: :xFract
map 'yFract', to: :yFract
map 'zFract', to: :zFract
map 'convention', to: :convention
map 'dictRef', to: :dict_ref
map 'ref', to: :ref
map 'isotopeRef', to: :isotope_ref
map 'isotopeListRef', to: :isotope_list_ref
map 'occupancy', to: :occupancy
map 'role', to: :role
map 'spaceGroupMultiplicity', to: :space_group_multiplicity
map 'pointGroupMultiplicity', to: :point_group_multiplicity
end
end
end
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