- class openpathsampling.MoveChange(subchanges=None, samples=None, mover=None, details=None, input_samples=None)
A class that described the concrete realization of a PathMove.
A list of newly generated samples by this particular move. Only used by node movers like RepEx or Shooters
list of Sample
the MoveChanges created by submovers
list of MoveChanges
an object that contains MoveType specific attributes and information. E.g. for a RandomChoiceMover which Mover was selected.
- __init__(subchanges=None, samples=None, mover=None, details=None, input_samples=None)
__init__([subchanges, samples, mover, ...])
Return a list of args of the __init__ function of a class
Return the most parent class actually derived from StorableObject
Return number of objects subclassed from StorableObject still in memory
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
Return a list of all subclassed objects
Reconstruct an object from a dictionary representaiton
Return the index which is used for the object in the given store.
Return a list of key : subtree tuples
Traverse the tree in post-order applying a function
Traverse the tree in pre-order applying a function
Apply a function to each node and return a nested tree of results
Return a tree with the movers of each node
Returns a dictionary of all storable objects
(De-)Activate observing creation of storable objects
Convert object into a dictionary representation
Return the object as a tree structure of nested lists of nodes
Returns if this particular move was accepted.
Return the base class
Return the name of the base class
Return the first non single-subchange
Return the class name as a string
Return a collapsed set of samples with non used samples removed
Return a compact representation of the change
Descriptor class to handle proxy objects in attributes
A unique identifier to build the unique key for a position in a tree
Returns a list of all samples that are accepted in this move
Return the single/only sub-movechange if there is only one.
Returns a list of all samples generated during the PathMove.