openpathsampling.ensemble.WrappedEnsemble
- class openpathsampling.ensemble.WrappedEnsemble(ensemble)[source]
Wraps an ensemble to alter it or the way it sees a trajectory
Methods
__init__
(ensemble)A path volume defines a set of paths.
args
()Return a list of args of the __init__ function of a class
base
()Return the most parent class actually derived from StorableObject
can_append
(trajectory[, trusted])Returns true, if the trajectory so far can still be in the ensemble if it is appended by a frame.
can_prepend
(trajectory[, trusted])Returns true, if the trajectory so far can still be in the ensemble if it is prepended by a frame.
check
(trajectory)Alias for __call__
check_reverse
(trajectory[, trusted])See __call__; same thing, but potentially in reverse frame order
count_weaks
()Return number of objects subclassed from StorableObject still in memory
descendants
()Return a list of all subclassed objects
extend_sample_from_trajectories
(...[, ...])Generate a sample in the ensemble by extending parts of trajectories
find_first_subtrajectory
(trajectory)Return the first sub-trajectory that matches the ensemble
find_last_subtrajectory
(trajectory)Return the last sub-trajectory that matches the ensemble
fix_name
()Set the objects name to be immutable.
from_dict
(dct)Reconstruct an object from a dictionary representaiton
get_sample_from_trajectories
(trajectories[, ...])Generate a sample in the ensemble by testing trajectories
get_uuid
()idx
(store)Return the index which is used for the object in the given store.
iter_extendable_slices
(trajectory[, ...])Return an iterator over maxiaml slices of extendable subtrajectories
iter_split
(trajectory[, max_length, ...])Return iterator over subtrajectories satisfying the given ensemble.
iter_valid_slices
(trajectory[, max_length, ...])Return an iterator over slices of subtrajectories matching the ensemble
named
(name)Name an unnamed object.
objects
()Returns a dictionary of all storable objects
reverse_uuid
()ruuid
(uid)set_observer
(active)(De-)Activate observing creation of storable objects
split
(trajectory[, max_length, min_length, ...])Return list of subtrajectories satisfying the given ensemble.
split_sample_from_trajectories
(trajectories)Generate a sample in the ensemble by searching for sub-parts
strict_can_append
(trajectory[, trusted])Returns true if the trajectory can be the beginning of a trajectory in the ensemble.
strict_can_prepend
(trajectory[, trusted])Returns true if the trajectory can be the end of a trajectory in the ensemble.
to_dict
()Convert object into a dictionary representation
trajectory_summary
(trajectory)Return dict with info on how this ensemble "sees" the trajectory.
trajectory_summary_str
(trajectory)Returns a string with the results of the trajectory_summary function.
Attributes
ACTIVE_LONG
CREATION_COUNT
INSTANCE_UUID
base_cls
Return the base class
base_cls_name
Return the name of the base class
cls
Return the class name as a string
default_name
Return the default name.
extendable_sub_ensembles
is_named
True if this object has a custom name.
name
Return the current name of the object.
observe_objects