.gitignore
CHANGELOG.md
LICENSE
README.md
__init__.py
_version.py
env.yml
env_dev.yml
env_material.yml
pyproject.toml
requirements.txt
settings.py
setup.py
.github/experiment_workflows/example_workflow.yml
.github/experiment_workflows/on_draft_release_creation.yml
.github/experiment_workflows/on_tag_creation_or_push.yml
.github/experiment_workflows/run_script_on_commit.yml
.github/workflows/python-publish.yml
benchmarks/benchmark_create_read_times.png
benchmarks/plotting_input_update_benchmarks.py
benchmarks/plotting_needle_in_haystack.py
benchmarks/plotting_results.py
benchmarks/plotting_update_full_results.py
benchmarks/plotting_update_into_constant_rows_results.py
benchmarks/plottting_alexandria.py
benchmarks/mongodb/needle_in_haystack_benchmark.py
benchmarks/mongodb/read_write_benchmark.py
benchmarks/mongodb/update_benchmark.py
benchmarks/mongodb/update_full_benchmark.py
benchmarks/parquetdb/delete_benchmark.py
benchmarks/parquetdb/experiment_benchmark.py
benchmarks/parquetdb/input_update_benchmark.py
benchmarks/parquetdb/needle_in_haystack_benchmark.py
benchmarks/parquetdb/optimized_update_benchmark.py
benchmarks/parquetdb/read_write_benchmark.py
benchmarks/parquetdb/schema_change_benchmark.py
benchmarks/parquetdb/update_benchmark.py
benchmarks/parquetdb/update_full_benchmark.py
benchmarks/sqlite/needle_in_haystack_benchmark.py
benchmarks/sqlite/read_write_benchmark.py
benchmarks/sqlite/update_benchmark.py
benchmarks/sqlite/update_full_benchmark.py
examples/notebooks/Example 1 - Introduction.ipynb
examples/scripts/Example 1 - 3D Alexandria Advanced.py
examples/scripts/Example 1 - 3D Alexandria Database.py
examples/scripts/Example 2 - Jarvis-dft_3d.py
examples/scripts/Example 3 - Jarvis-alex_pbe_2d_all.py
examples/scripts/Example 3 - Jarvis-alex_pbe_3d_all.py
examples/scripts/imputed_periodic_table_values.csv
parquetdb/__init__.py
parquetdb/_version.py
parquetdb.egg-info/PKG-INFO
parquetdb.egg-info/SOURCES.txt
parquetdb.egg-info/dependency_links.txt
parquetdb.egg-info/requires.txt
parquetdb.egg-info/top_level.txt
parquetdb/core/__init__.py
parquetdb/core/parquetdb.py
parquetdb/core/transaction.py
parquetdb/core/types.py
parquetdb/utils/__init__.py
parquetdb/utils/config.py
parquetdb/utils/config.yml
parquetdb/utils/data_utils.py
parquetdb/utils/external_utils.py
parquetdb/utils/general_utils.py
parquetdb/utils/matplotlib_utils.py
parquetdb/utils/mp_utils.py
parquetdb/utils/plot_utils.py
parquetdb/utils/pyarrow_utils.py
scripts/run_tests.py
scripts/tmp.py
scripts/github_workflow/utils.py
scripts/github_workflow/workflow_delete_release.py
scripts/github_workflow/workflow_generate_changlog_on_recent_tag.py
scripts/github_workflow/workflow_update_release_body.py
tests/test_parquetdb.py
tests/test_types.py
tests/data/alexandria_test.json