Index

_

__delitem__() (colabfit.tools.property.Property method) __eq__() (colabfit.tools.configuration.Configuration method) (colabfit.tools.property.Property method) (colabfit.tools.property_settings.PropertySettings method) __getitem__() (colabfit.tools.property.Property method) __hash__() (colabfit.tools.configuration.Configuration method) (colabfit.tools.configuration_set.ConfigurationSet method) (colabfit.tools.dataset.Dataset method) (colabfit.tools.property.Property method) (colabfit.tools.property_settings.PropertySettings method) __init__() (colabfit.tools.configuration.Configuration method) (colabfit.tools.configuration_set.ConfigurationSet method) (colabfit.tools.property.Property method) (colabfit.tools.property_settings.PropertySettings method)

__repr__() (colabfit.tools.configuration_set.ConfigurationSet method) (colabfit.tools.property.Property method) (colabfit.tools.property_settings.PropertySettings method) __setitem__() (colabfit.tools.property.Property method) __str__() (colabfit.tools.configuration.Configuration method) (colabfit.tools.configuration_set.ConfigurationSet method) (colabfit.tools.property.Property method) (colabfit.tools.property_settings.PropertySettings method) __weakref__ (colabfit.tools.configuration_set.ConfigurationSet attribute) (colabfit.tools.property.Property attribute) (colabfit.tools.property_settings.PropertySettings attribute) _load() (colabfit.tools.converters.FolderConverter method)

A

aggregate_configuration_info() (colabfit.tools.database.MongoDatabase method) aggregate_configuration_set_info() (colabfit.tools.database.MongoDatabase method) aggregate_dataset_info() (colabfit.tools.database.MongoDatabase method) aggregate_property_info() (colabfit.tools.database.MongoDatabase method)

aggregated_info (colabfit.tools.configuration_set.ConfigurationSet attribute) (colabfit.tools.dataset.Dataset attribute) apply_labels() (colabfit.tools.database.MongoDatabase method) authors (colabfit.tools.dataset.Dataset attribute)

B

BaseConverter (class in colabfit.tools.converters)

BaseTransform (class in colabfit.tools.transformations)

C

CFGConverter (class in colabfit.tools.converters) colabfit.tools.configuration module colabfit.tools.configuration_set module colabfit.tools.converters module colabfit.tools.database module colabfit.tools.property module colabfit.tools.property_settings module

colabfit.tools.transformations module concatenate_configurations() (colabfit.tools.database.MongoDatabase method) Configuration (class in colabfit.tools.configuration) configuration_ids (colabfit.tools.configuration_set.ConfigurationSet attribute) (colabfit.tools.property.Property attribute) configuration_set_ids (colabfit.tools.dataset.Dataset attribute) configuration_sets (colabfit.tools.database.MongoDatabase attribute) configurations (colabfit.tools.database.MongoDatabase attribute) ConfigurationSet (class in colabfit.tools.configuration_set) convert_units() (colabfit.tools.property.Property method)

D

database_name (colabfit.tools.database.MongoDatabase attribute) Dataset (class in colabfit.tools.dataset) dataset_from_markdown() (colabfit.tools.database.MongoDatabase method) dataset_to_markdown() (colabfit.tools.database.MongoDatabase method)

datasets (colabfit.tools.database.MongoDatabase attribute) definition (colabfit.tools.property.Property attribute) description (colabfit.tools.configuration_set.ConfigurationSet attribute) (colabfit.tools.dataset.Dataset attribute) (colabfit.tools.property_settings.PropertySettings attribute)

E

EXYZConverter (class in colabfit.tools.converters)

F

fields (colabfit.tools.property_settings.PropertySettings attribute) files (colabfit.tools.property_settings.PropertySettings attribute) filter_on_configurations() (colabfit.tools.database.MongoDatabase method)

filter_on_properties() (colabfit.tools.database.MongoDatabase method) FolderConverter (class in colabfit.tools.converters) from_ase() (colabfit.tools.configuration.Configuration class method) from_definition() (colabfit.tools.property.Property class method)

G

get_configuration() (colabfit.tools.database.MongoDatabase method) get_configuration_set() (colabfit.tools.database.MongoDatabase method) get_configurations() (colabfit.tools.database.MongoDatabase method) get_data() (colabfit.tools.database.MongoDatabase method) (colabfit.tools.property.Property method)

get_dataset() (colabfit.tools.database.MongoDatabase method) get_property_definition() (colabfit.tools.database.MongoDatabase method) get_property_settings() (colabfit.tools.database.MongoDatabase method) get_statistics() (colabfit.tools.database.MongoDatabase method)

I

insert_configuration_set() (colabfit.tools.database.MongoDatabase method) insert_data() (colabfit.tools.database.MongoDatabase method) insert_dataset() (colabfit.tools.database.MongoDatabase method)

insert_property_definition() (colabfit.tools.database.MongoDatabase method) insert_property_settings() (colabfit.tools.database.MongoDatabase method) instance (colabfit.tools.property.Property attribute)

K

keys() (colabfit.tools.property.Property method)

L

labels (colabfit.tools.property_settings.PropertySettings attribute) links (colabfit.tools.dataset.Dataset attribute)

load() (colabfit.tools.converters.BaseConverter method) load_data() (in module colabfit.tools.database)

M

method (colabfit.tools.property_settings.PropertySettings attribute) module colabfit.tools.configuration colabfit.tools.configuration_set colabfit.tools.converters colabfit.tools.database colabfit.tools.property colabfit.tools.property_settings colabfit.tools.transformations

MongoDatabase (class in colabfit.tools.database)

N

name (colabfit.tools.dataset.Dataset attribute)

P

PerAtomEnergies (class in colabfit.tools.transformations) plot_histograms() (colabfit.tools.database.MongoDatabase method) properties (colabfit.tools.database.MongoDatabase attribute) Property (class in colabfit.tools.property)

property_definitions (colabfit.tools.database.MongoDatabase attribute) property_ids (colabfit.tools.dataset.Dataset attribute) property_map (colabfit.tools.property.Property attribute) property_settings (colabfit.tools.database.MongoDatabase attribute) PropertySettings (class in colabfit.tools.property_settings)

R

ReshapeForces (class in colabfit.tools.transformations)

resync_configuration_set() (colabfit.tools.database.MongoDatabase method) resync_dataset() (colabfit.tools.database.MongoDatabase method)

S

Sequential (class in colabfit.tools.transformations)

settings (colabfit.tools.property.Property attribute) SubtractDivide (class in colabfit.tools.transformations)