Index _ | A | B | C | D | E | G | H | I | J | K | L | M | N | O | P | R | S | T | U | V | Z _ __contains__() (metatensor.torch.Labels method) __eq__() (metatensor.torch.Labels method) (metatensor.torch.LabelsEntry method) __getitem__() (metatensor.torch.Labels method) (metatensor.torch.LabelsEntry method) (metatensor.torch.TensorMap method) __len__() (metatensor.torch.Labels method) (metatensor.torch.LabelsEntry method) (metatensor.torch.TensorMap method) __ne__() (metatensor.torch.Labels method) (metatensor.torch.LabelsEntry method) A abs() (in module metatensor) add() (in module metatensor) add_gradient() (metatensor.TensorBlock method) (metatensor.torch.TensorBlock method) allclose() (in module metatensor) allclose_block() (in module metatensor) allclose_block_raise() (in module metatensor) allclose_raise() (in module metatensor) append() (metatensor.Labels method) (metatensor.torch.Labels method) append_dimension() (in module metatensor) Array (class in metatensor.data) B block() (metatensor.TensorMap method) (metatensor.torch.TensorMap method) block_by_id() (metatensor.TensorMap method) (metatensor.torch.TensorMap method) block_from_array() (in module metatensor) block_to() (in module metatensor) blocks() (metatensor.TensorMap method) (metatensor.torch.TensorMap method) blocks_by_id() (metatensor.TensorMap method) (metatensor.torch.TensorMap method) blocks_matching() (metatensor.TensorMap method) (metatensor.torch.TensorMap method) C checks_enabled() (in module metatensor) cmake_prefix_path (in module metatensor.utils) column() (metatensor.Labels method) (metatensor.torch.Labels method) component_names (metatensor.TensorMap property) (metatensor.torch.TensorMap property) components (metatensor.TensorBlock property) (metatensor.torch.TensorBlock property) components_to_properties() (metatensor.TensorMap method) (metatensor.torch.TensorMap method) copy() (metatensor.TensorBlock method) (metatensor.TensorMap method) (metatensor.torch.TensorBlock method) (metatensor.torch.TensorMap method) create_numpy_array() (in module metatensor.io) create_torch_array() (in module metatensor.io) D divide() (in module metatensor) dot() (in module metatensor) drop_blocks() (in module metatensor) E empty() (metatensor.Labels static method) (metatensor.torch.Labels static method) empty_like() (in module metatensor) empty_like_block() (in module metatensor) entry() (metatensor.Labels method) (metatensor.torch.Labels method) equal() (in module metatensor) equal_block() (in module metatensor) equal_block_raise() (in module metatensor) equal_metadata() (in module metatensor) equal_metadata_block() (in module metatensor) equal_metadata_block_raise() (in module metatensor) equal_metadata_raise() (in module metatensor) equal_raise() (in module metatensor) ExternalCpuArray (class in metatensor.data) G gradient() (metatensor.TensorBlock method) (metatensor.torch.TensorBlock method) gradients() (metatensor.TensorBlock method) (metatensor.torch.TensorBlock method) gradients_list() (metatensor.TensorBlock method) (metatensor.torch.TensorBlock method) H has_gradient() (metatensor.TensorBlock method) (metatensor.torch.TensorBlock method) I insert() (metatensor.Labels method) (metatensor.torch.Labels method) insert_dimension() (in module metatensor) intersection() (metatensor.Labels method) (metatensor.torch.Labels method) intersection_and_mapping() (metatensor.Labels method) (metatensor.torch.Labels method) is_view() (metatensor.Labels method) (metatensor.torch.Labels method) items() (metatensor.TensorMap method) (metatensor.torch.TensorMap method) J join() (in module metatensor) K keys (metatensor.TensorMap property) (metatensor.torch.TensorMap property) keys_to_properties() (metatensor.TensorMap method) (metatensor.torch.TensorMap method) keys_to_samples() (metatensor.TensorMap method) (metatensor.torch.TensorMap method) L Labels (class in metatensor) (class in metatensor.torch) LabelsEntry (class in metatensor.labels) (class in metatensor.torch) LabelsValues (class in metatensor.labels) load() (in module metatensor) (in module metatensor.torch) load_buffer_custom_array() (in module metatensor.io) load_custom_array() (in module metatensor.io) lstsq() (in module metatensor) M mean_over_samples() (in module metatensor) mean_over_samples_block() (in module metatensor) metatensor.operations.checks module metatensor.operations.manipulate_dimension module metatensor.operations.reduce_over_samples module metatensor::DataArrayBase (C++ class) metatensor::DataArrayBase::copy (C++ function) metatensor::DataArrayBase::create (C++ function) metatensor::DataArrayBase::data (C++ function) metatensor::DataArrayBase::DataArrayBase (C++ function), [1] metatensor::DataArrayBase::move_samples_from (C++ function) metatensor::DataArrayBase::operator= (C++ function), [1] metatensor::DataArrayBase::origin (C++ function) metatensor::DataArrayBase::reshape (C++ function) metatensor::DataArrayBase::shape (C++ function) metatensor::DataArrayBase::swap_axes (C++ function) metatensor::DataArrayBase::to_mts_array_t (C++ function) metatensor::EmptyDataArray (C++ class) metatensor::EmptyDataArray::EmptyDataArray (C++ function), [1], [2] metatensor::EmptyDataArray::operator= (C++ function), [1] metatensor::Error (C++ class) metatensor::Error::Error (C++ function) metatensor::Labels (C++ class) metatensor::Labels::as_mts_labels_t (C++ function) metatensor::Labels::count (C++ function) metatensor::Labels::Labels (C++ function), [1], [2], [3], [4] metatensor::Labels::names (C++ function) metatensor::Labels::operator= (C++ function), [1] metatensor::Labels::position (C++ function), [1], [2], [3] metatensor::Labels::set_intersection (C++ function), [1] metatensor::Labels::set_union (C++ function), [1] metatensor::Labels::set_user_data (C++ function) metatensor::Labels::size (C++ function) metatensor::Labels::user_data (C++ function) metatensor::Labels::values (C++ function) metatensor::LabelsUserData (C++ class) metatensor::LabelsUserData::LabelsUserData (C++ function), [1], [2] metatensor::LabelsUserData::operator= (C++ function), [1] metatensor::NDArray (C++ class) metatensor::NDArray::data (C++ function), [1] metatensor::NDArray::is_empty (C++ function) metatensor::NDArray::is_view (C++ function) metatensor::NDArray::NDArray (C++ function), [1], [2], [3], [4], [5] metatensor::NDArray::operator() (C++ function), [1] metatensor::NDArray::operator= (C++ function), [1] metatensor::NDArray::shape (C++ function) metatensor::SimpleDataArray (C++ class) metatensor::SimpleDataArray::from_mts_array (C++ function), [1] metatensor::SimpleDataArray::operator= (C++ function), [1] metatensor::SimpleDataArray::SimpleDataArray (C++ function), [1], [2], [3] metatensor::SimpleDataArray::view (C++ function), [1] metatensor::TensorBlock (C++ class) metatensor::TensorBlock::add_gradient (C++ function) metatensor::TensorBlock::as_mts_block_t (C++ function), [1] metatensor::TensorBlock::clone (C++ function) metatensor::TensorBlock::clone_metadata_only (C++ function) metatensor::TensorBlock::components (C++ function) metatensor::TensorBlock::gradient (C++ function) metatensor::TensorBlock::gradients_list (C++ function) metatensor::TensorBlock::labels (C++ function) metatensor::TensorBlock::mts_array (C++ function) metatensor::TensorBlock::operator= (C++ function), [1] metatensor::TensorBlock::properties (C++ function) metatensor::TensorBlock::samples (C++ function) metatensor::TensorBlock::TensorBlock (C++ function), [1], [2] metatensor::TensorBlock::unsafe_from_ptr (C++ function) metatensor::TensorBlock::unsafe_view_from_ptr (C++ function) metatensor::TensorBlock::values (C++ function) metatensor::TensorBlock::values_shape (C++ function) metatensor::TensorMap (C++ class) metatensor::TensorMap::as_mts_tensormap_t (C++ function), [1] metatensor::TensorMap::block_by_id (C++ function) metatensor::TensorMap::blocks_matching (C++ function) metatensor::TensorMap::clone (C++ function) metatensor::TensorMap::clone_metadata_only (C++ function) metatensor::TensorMap::components_to_properties (C++ function), [1] metatensor::TensorMap::keys (C++ function) metatensor::TensorMap::keys_to_properties (C++ function), [1], [2] metatensor::TensorMap::keys_to_samples (C++ function), [1], [2] metatensor::TensorMap::load (C++ function) metatensor::TensorMap::load_buffer (C++ function), [1], [2] metatensor::TensorMap::operator= (C++ function), [1] metatensor::TensorMap::save (C++ function) metatensor::TensorMap::save_buffer (C++ function) metatensor::TensorMap::save_string_buffer (C++ function) metatensor::TensorMap::TensorMap (C++ function), [1], [2], [3] metatensor_torch::LabelsEntryHolder (C++ class) metatensor_torch::LabelsEntryHolder::getitem (C++ function) metatensor_torch::LabelsEntryHolder::LabelsEntryHolder (C++ function) metatensor_torch::LabelsEntryHolder::names (C++ function) metatensor_torch::LabelsEntryHolder::operator[] (C++ function), [1] metatensor_torch::LabelsEntryHolder::print (C++ function) metatensor_torch::LabelsEntryHolder::repr (C++ function) metatensor_torch::LabelsEntryHolder::size (C++ function) metatensor_torch::LabelsEntryHolder::values (C++ function) metatensor_torch::LabelsHolder (C++ class) metatensor_torch::LabelsHolder::append (C++ function) metatensor_torch::LabelsHolder::as_metatensor (C++ function) metatensor_torch::LabelsHolder::column (C++ function) metatensor_torch::LabelsHolder::count (C++ function) metatensor_torch::LabelsHolder::create (C++ function) metatensor_torch::LabelsHolder::empty (C++ function) metatensor_torch::LabelsHolder::insert (C++ function) metatensor_torch::LabelsHolder::intersection_and_mapping (C++ function) metatensor_torch::LabelsHolder::is_view (C++ function) metatensor_torch::LabelsHolder::LabelsHolder (C++ function), [1] metatensor_torch::LabelsHolder::names (C++ function) metatensor_torch::LabelsHolder::permute (C++ function) metatensor_torch::LabelsHolder::position (C++ function) metatensor_torch::LabelsHolder::print (C++ function) metatensor_torch::LabelsHolder::range (C++ function) metatensor_torch::LabelsHolder::remove (C++ function) metatensor_torch::LabelsHolder::rename (C++ function) metatensor_torch::LabelsHolder::repr (C++ function) metatensor_torch::LabelsHolder::set_intersection (C++ function) metatensor_torch::LabelsHolder::set_union (C++ function) metatensor_torch::LabelsHolder::single (C++ function) metatensor_torch::LabelsHolder::size (C++ function) metatensor_torch::LabelsHolder::str (C++ function) metatensor_torch::LabelsHolder::to (C++ function) metatensor_torch::LabelsHolder::to_owned (C++ function) metatensor_torch::LabelsHolder::union_and_mapping (C++ function) metatensor_torch::LabelsHolder::values (C++ function) metatensor_torch::LabelsHolder::view (C++ function) metatensor_torch::load (C++ function) metatensor_torch::save (C++ function) metatensor_torch::TensorBlockHolder (C++ class) metatensor_torch::TensorBlockHolder::add_gradient (C++ function) metatensor_torch::TensorBlockHolder::as_metatensor (C++ function) metatensor_torch::TensorBlockHolder::components (C++ function) metatensor_torch::TensorBlockHolder::copy (C++ function) metatensor_torch::TensorBlockHolder::gradient (C++ function) metatensor_torch::TensorBlockHolder::gradients (C++ function) metatensor_torch::TensorBlockHolder::gradients_list (C++ function) metatensor_torch::TensorBlockHolder::has_gradient (C++ function) metatensor_torch::TensorBlockHolder::labels (C++ function) metatensor_torch::TensorBlockHolder::properties (C++ function) metatensor_torch::TensorBlockHolder::repr (C++ function) metatensor_torch::TensorBlockHolder::samples (C++ function) metatensor_torch::TensorBlockHolder::TensorBlockHolder (C++ function), [1] metatensor_torch::TensorBlockHolder::values (C++ function) metatensor_torch::TensorMapHolder (C++ class) metatensor_torch::TensorMapHolder::as_metatensor (C++ function) metatensor_torch::TensorMapHolder::block (C++ function), [1], [2] metatensor_torch::TensorMapHolder::block_by_id (C++ function) metatensor_torch::TensorMapHolder::block_torch (C++ function) metatensor_torch::TensorMapHolder::blocks (C++ function), [1], [2], [3] metatensor_torch::TensorMapHolder::blocks_by_id (C++ function) metatensor_torch::TensorMapHolder::blocks_matching (C++ function) metatensor_torch::TensorMapHolder::blocks_torch (C++ function) metatensor_torch::TensorMapHolder::component_names (C++ function) metatensor_torch::TensorMapHolder::components_to_properties (C++ function) metatensor_torch::TensorMapHolder::copy (C++ function) metatensor_torch::TensorMapHolder::items (C++ function) metatensor_torch::TensorMapHolder::keys (C++ function) metatensor_torch::TensorMapHolder::keys_to_properties (C++ function) metatensor_torch::TensorMapHolder::keys_to_samples (C++ function) metatensor_torch::TensorMapHolder::print (C++ function) metatensor_torch::TensorMapHolder::property_names (C++ function) metatensor_torch::TensorMapHolder::sample_names (C++ function) metatensor_torch::TensorMapHolder::TensorMapHolder (C++ function), [1] metatensor_torch::TorchLabels (C++ type) metatensor_torch::TorchLabelsEntry (C++ type) metatensor_torch::TorchTensorBlock (C++ type) metatensor_torch::TorchTensorMap (C++ type) MetatensorError (class in metatensor) module metatensor.operations.checks metatensor.operations.manipulate_dimension metatensor.operations.reduce_over_samples mts_array_t (C struct) mts_array_t.copy (C var) mts_array_t.create (C var) mts_array_t.data (C var) mts_array_t.destroy (C var) mts_array_t.move_samples_from (C var) mts_array_t.origin (C var) mts_array_t.ptr (C var) mts_array_t.reshape (C var) mts_array_t.shape (C var) mts_array_t.swap_axes (C var) mts_block (C function) mts_block_add_gradient (C function) mts_block_copy (C function) mts_block_data (C function) mts_block_free (C function) mts_block_gradients_list (C function) mts_block_labels (C function) mts_block_t (C type) MTS_BUFFER_SIZE_ERROR (C macro) mts_create_array_callback_t (C type) mts_get_data_origin (C function) MTS_INTERNAL_ERROR (C macro) MTS_INVALID_PARAMETER_ERROR (C macro) mts_labels_clone (C function) mts_labels_create (C function) mts_labels_free (C function) mts_labels_intersection (C function) mts_labels_position (C function) mts_labels_set_user_data (C function) mts_labels_t (C struct) mts_labels_t.count (C var) mts_labels_t.internal_ptr_ (C var) mts_labels_t.names (C var) mts_labels_t.size (C var) mts_labels_t.values (C var) mts_labels_union (C function) mts_labels_user_data (C function) mts_last_error (C function) mts_register_data_origin (C function) mts_status_t (C type) MTS_SUCCESS (C macro) mts_tensormap (C function) mts_tensormap_block_by_id (C function) mts_tensormap_blocks_matching (C function) mts_tensormap_components_to_properties (C function) mts_tensormap_copy (C function) mts_tensormap_free (C function) mts_tensormap_keys (C function) mts_tensormap_keys_to_properties (C function) mts_tensormap_keys_to_samples (C function) mts_tensormap_load (C function) mts_tensormap_load_buffer (C function) mts_tensormap_save (C function) mts_tensormap_save_buffer (C function) mts_tensormap_t (C type) multiply() (in module metatensor) N names (metatensor.Labels property) (metatensor.labels.LabelsEntry property) (metatensor.torch.Labels property) (metatensor.torch.LabelsEntry property) NotEqualError() (in module metatensor) O one_hot() (in module metatensor) ones_like() (in module metatensor) ones_like_block() (in module metatensor) P permute() (metatensor.Labels method) (metatensor.torch.Labels method) permute_dimensions() (in module metatensor) position() (metatensor.Labels method) (metatensor.torch.Labels method) pow() (in module metatensor) print() (metatensor.Labels method) (metatensor.labels.LabelsEntry method) (metatensor.TensorMap method) (metatensor.torch.Labels method) (metatensor.torch.LabelsEntry method) (metatensor.torch.TensorMap method) properties (metatensor.TensorBlock property) (metatensor.torch.TensorBlock property) property_names (metatensor.TensorMap property) (metatensor.torch.TensorMap property) R random_uniform_like() (in module metatensor) random_uniform_like_block() (in module metatensor) range() (metatensor.Labels static method) (metatensor.torch.Labels static method) register_external_data_wrapper() (in module metatensor.data) remove() (metatensor.Labels method) (metatensor.torch.Labels method) remove_dimension() (in module metatensor) remove_gradients() (in module metatensor) rename() (metatensor.Labels method) (metatensor.torch.Labels method) rename_dimension() (in module metatensor) S sample_names (metatensor.TensorMap property) (metatensor.torch.TensorMap property) samples (metatensor.TensorBlock property) (metatensor.torch.TensorBlock property) save() (in module metatensor) (in module metatensor.torch) single() (metatensor.Labels static method) (metatensor.torch.Labels static method) slice() (in module metatensor) slice_block() (in module metatensor) solve (class in metatensor) sort() (in module metatensor) sort_block() (in module metatensor) split() (in module metatensor) split_block() (in module metatensor) std_over_samples() (in module metatensor) std_over_samples_block() (in module metatensor) subtract() (in module metatensor) sum_over_samples() (in module metatensor) sum_over_samples_block() (in module metatensor) T TensorBlock (class in metatensor) (class in metatensor.torch) TensorMap (class in metatensor) (class in metatensor.torch) to() (in module metatensor) (metatensor.Labels method) (metatensor.torch.Labels method) to_owned() (metatensor.Labels method) (metatensor.torch.Labels method) U union() (metatensor.Labels method) (metatensor.torch.Labels method) union_and_mapping() (metatensor.Labels method) (metatensor.torch.Labels method) unique_metadata() (in module metatensor) unique_metadata_block() (in module metatensor) unsafe_disable_checks() (in module metatensor) unsafe_enable_checks() (in module metatensor) V values (metatensor.Labels property) (metatensor.labels.LabelsEntry property) (metatensor.TensorBlock property) (metatensor.torch.Labels property) (metatensor.torch.LabelsEntry property) (metatensor.torch.TensorBlock property) var_over_samples() (in module metatensor) var_over_samples_block() (in module metatensor) view() (metatensor.Labels method) (metatensor.torch.Labels method) Z zeros_like() (in module metatensor) zeros_like_block() (in module metatensor)