| license: gpl-2.0 | |
| Train and val data for BAMBOO. | |
| For testing the code, the data files train_data.pt and val_data.pt are located in the ./mini/ directory. | |
| To reproduce the model described in the paper, please use all the .pt files in the ./train/ directory and all the .pt files in the ./val/ directory. | |
| Github repo: https://github.com/bytedance/bamboo | |
| Paper: A predictive machine learning force-field framework for liquid electrolyte development | |
| DOI: https://doi.org/10.1038/s42256-025-01009-7 |