LICENSE
README.md
pyproject.toml
setup.cfg
carate/__init__.py
carate/default_interface.py
carate/main.py
carate.egg-info/PKG-INFO
carate.egg-info/SOURCES.txt
carate.egg-info/dependency_links.txt
carate.egg-info/entry_points.txt
carate.egg-info/requires.txt
carate.egg-info/top_level.txt
carate/cli/__init__.py
carate/cli/automate.py
carate/config_adapter/__init__.py
carate/config_adapter/config.py
carate/dataset/__init__.py
carate/dataset/qm9.py
carate/evaluation/__init__.py
carate/evaluation/base.py
carate/evaluation/classification.py
carate/evaluation/classification_whole_dataset.py
carate/evaluation/regression.py
carate/loader/__init__.py
carate/loader/load_data.py
carate/logging/__init__.py
carate/logging/metrics_logger.py
carate/models/__init__.py
carate/models/base_model.py
carate/models/cc_classification.py
carate/models/cc_regression.py
carate/models/cgc_classification.py
carate/models/cgc_classification_jax.py
carate/models/cgc_regression.py
carate/models/cgc_regression_jax.py
carate/models/g_classification.py
carate/models/g_regression.py
carate/models/gatv2_classification.py
carate/models/gatv2_regression.py
carate/models/gcc_classification.py
carate/models/gcc_regression.py
carate/models/graph_transformer_classification.py
carate/models/graph_transformer_regression.py
carate/optimizer/__init__.py
carate/optimizer/optimizer.py
carate/plotting/__init__.py
carate/plotting/base_plots.py
carate/plotting/multi_run.py
carate/runner/__init__.py
carate/runner/run.py
carate/statistics/__init__.py
carate/statistics/analysis.py
carate/utils/__init__.py
carate/utils/convert_to_json.py
carate/utils/model_files.py
carate/utils/training_result_parser.py
tests/test_classification.py
tests/test_cli.py
tests/test_config.py
tests/test_data_loader.py
tests/test_logger.py
tests/test_plotting.py
tests/test_regression.py
tests/test_runner.py
tests/test_utils_convert_py_to_json.py