meld.system.mapping.PeakMapper
- class meld.system.mapping.PeakMapper(name, n_peaks, atom_names)[source]
Bases:
object
Methods
__init__
(name, n_peaks, atom_names)add_atom_group
(**kwargs)extract_value
(mapping, state)- rtype
Union
[int
,NotMapped
]
get_initial_state
()- rtype
ndarray
get_mapping
(peak_id, atom_name)- rtype
sample
(state)- rtype
ndarray
Attributes
n_atom_groups
- rtype
int
name
n_peaks
atom_names
atom_groups