Name		Name	Last commit message	Last commit date
parent directory ..
graph_explanation		graph_explanation
README.md		README.md
example_transfer_learning.ipynb		example_transfer_learning.ipynb
showcase_energy_force_model.ipynb		showcase_energy_force_model.ipynb
showcase_hdnnp2nd_dipole.ipynb		showcase_hdnnp2nd_dipole.ipynb
tutorial_config_training.ipynb		tutorial_config_training.ipynb
tutorial_custom_crystal_dataset.ipynb		tutorial_custom_crystal_dataset.ipynb
tutorial_custom_moleculenet.ipynb		tutorial_custom_moleculenet.ipynb
tutorial_custom_qm_dataset.ipynb		tutorial_custom_qm_dataset.ipynb
tutorial_graph_dict.ipynb		tutorial_graph_dict.ipynb
tutorial_hyper_keras_tuner.ipynb		tutorial_hyper_keras_tuner.ipynb
tutorial_hyper_optuna.ipynb		tutorial_hyper_optuna.ipynb
tutorial_jax_jit.ipynb		tutorial_jax_jit.ipynb
tutorial_model_loading_options.ipynb		tutorial_model_loading_options.ipynb
tutorial_optimizer.ipynb		tutorial_optimizer.ipynb
workflow_molecule_regression.ipynb		workflow_molecule_regression.ipynb
workflow_qm_regression.ipynb		workflow_qm_regression.ipynb

README.md

Notebooks

Example notebooks to show usage of kgcnn.