LICENSE.txt
MANIFEST.in
README.md
SMILES_used_for_training.pkl
pyproject.toml
setup.py
./requirements/requirements.txt
./requirements/test_requirements.txt
tgapp.egg-info/PKG-INFO
tgapp.egg-info/SOURCES.txt
tgapp.egg-info/dependency_links.txt
tgapp.egg-info/requires.txt
tgapp.egg-info/top_level.txt
tgboost/VERSION
tgboost/__init__.py
tgboost/config.yml
tgboost/predict.py
tgboost/regressor.py
tgboost/train_pipeline.py
tgboost/transformer.py
tgboost/config/__init__.py
tgboost/config/core.py
tgboost/datasets/BradleyDoublePlusGoodMeltingPointDataset_Highly_Curated_and_Validated.xlsx
tgboost/datasets/Koop_dataset.csv
tgboost/datasets/Koop_dataset_Rothfuss_t0_bis.csv
tgboost/datasets/__init__.py
tgboost/datasets/test.csv
tgboost/datasets/train.csv
tgboost/processing/__init__.py
tgboost/processing/data_manager.py
tgboost/processing/smiles_manager.py
tgboost/processing/validation.py
tgboost/trained_models/__init__.py
tgboost/trained_models/model_300dim.pkl
tgboost/trained_models/tgModel_output_v0.0.4.pkl
tgboost/trained_models/tgModel_transformer_pipe_v0.0.4.pkl