openpathsampling.MoveChange
- class openpathsampling.MoveChange(subchanges=None, samples=None, mover=None, details=None, input_samples=None)[source]
A class that described the concrete realization of a PathMove.
- samples
A list of newly generated samples by this particular move. Only used by node movers like RepEx or Shooters
- Type:
list of Sample
- subchanges
the MoveChanges created by submovers
- Type:
list of MoveChanges
- details
an object that contains MoveType specific attributes and information. E.g. for a RandomChoiceMover which Mover was selected.
- Type:
Methods
__init__([subchanges, samples, mover, ...])args()Return a list of args of the __init__ function of a class
base()Return the most parent class actually derived from StorableObject
count_weaks()Return number of objects subclassed from StorableObject still in memory
depth_post_order(fnc[, level])Traverse the tree in post-order applying a function with depth
depth_pre_order(fnc[, level, only_canonical])Traverse the tree of node in pre-order applying a function
descendants()Return a list of all subclassed objects
from_dict(dct)Reconstruct an object from a dictionary representaiton
get_uuid()idx(store)Return the index which is used for the object in the given store.
key(change)keylist()Return a list of key : subtree tuples
map_post_order(fnc, **kwargs)Traverse the tree in post-order applying a function
map_pre_order(fnc, **kwargs)Traverse the tree in pre-order applying a function
map_tree(fnc)Apply a function to each node and return a nested tree of results
movetree()Return a tree with the movers of each node
objects()Returns a dictionary of all storable objects
reverse_uuid()ruuid(uid)set_observer(active)(De-)Activate observing creation of storable objects
to_dict()Convert object into a dictionary representation
tree()Return the object as a tree structure of nested lists of nodes
Attributes
ACTIVE_LONGCREATION_COUNTINSTANCE_UUIDacceptedReturns if this particular move was accepted.
base_clsReturn the base class
base_cls_nameReturn the name of the base class
canonicalReturn the first non single-subchange
clsReturn the class name as a string
collapsed_samplesReturn a collapsed set of samples with non used samples removed
descriptionReturn a compact representation of the change
Descriptor class to handle proxy objects in attributes
identifierA unique identifier to build the unique key for a position in a tree
observe_objectsresultsReturns a list of all samples that are accepted in this move
subchangeReturn the single/only sub-movechange if there is only one.
submoverstrialsReturns a list of all samples generated during the PathMove.