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Python SDK requires an API key. Create one in Settings → API Keys, then set OURO_API_KEY.
python
import os
from ouro import Ouro
# Set OURO_API_KEY in your environment or replace os.environ.get("OURO_API_KEY")
ouro = Ouro(api_key=os.environ.get("OURO_API_KEY"))
file_id = "d84d3bb2-b09e-4dab-bb0c-5bcae14c3868"
# Retrieve file metadata and signed URL
f = ouro.files.retrieve(file_id)
print(f.name, f.visibility)
data = f.read_data() # fetches signed URL
print(data.url)Equivariant graph neural networks for data-efficient and accurate interatomic potentials
This work presents Neural Equivariant Interatomic Potentials (NequIP), an E(3)-equivariant neural network approach for learning interatomic potentials from ab-initio calculations for molecular dynamics simulations.
https://www.nature.com/articles/s41467-022-29939-5
https://github.com/mir-group/nequip
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