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README.md
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- training
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- inference
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datasets:
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- OneScience-
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- OneScience-
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- OneScience-
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- OneScience-
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---
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<p align="center">
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### Download the Model Package
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```bash
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hf download --model OneScience-
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cd mace
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```
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Training data is not bundled with this repository. Using the introductory DMC dataset as an example, download it from Hugging Face to `data/` in the repository root:
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```bash
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hf download --dataset OneScience-
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```
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After downloading, the data is located at `data/data/DMC/`. `scripts/demo/run.sh` automatically sets the repository root as `ONESCIENCE_DATASETS_DIR`, so you do not need to set this variable manually for the paths in the configuration file to resolve.
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- training
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- inference
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datasets:
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- OneScience-Group/DMC
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- OneScience-Group/ANI1x
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- OneScience-Group/water
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- OneScience-Group/nanotube
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---
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<p align="center">
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### Download the Model Package
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```bash
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hf download --model OneScience-Group/MACE --local-dir ./mace
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cd mace
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```
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Training data is not bundled with this repository. Using the introductory DMC dataset as an example, download it from Hugging Face to `data/` in the repository root:
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```bash
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+
hf download --dataset OneScience-Group/DMC --local-dir ./data
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```
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After downloading, the data is located at `data/data/DMC/`. `scripts/demo/run.sh` automatically sets the repository root as `ONESCIENCE_DATASETS_DIR`, so you do not need to set this variable manually for the paths in the configuration file to resolve.
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