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OneScience-Sugon
/
MatterSim
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OneScience
8
English
OneScience
MatterSim
materials-science
molecular-simulation
machine-learning-potential
graph-neural-network
equivariant-neural-network
inference
fine-tuning
License:
mit
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main
MatterSim
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scripts
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1 commit
dadadaxi
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batch_inference.py
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finetune.py
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finetune_config.yaml
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md.py
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relax.py
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single_point.py
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