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update metatomic checkpoint to fix tests #223

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Merged
merged 3 commits into from
Jul 25, 2025
Merged

update metatomic checkpoint to fix tests #223

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19a4c7e
update metatomic checkpoint to fix tests
curtischong Jul 23, 2025
0fa3a68
update pymatviz source
curtischong Jul 23, 2025
bc20156
try to fix vesin-torch dep issues
curtischong Jul 23, 2025
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2 changes: 1 addition & 1 deletion tests/models/test_metatomic.py
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Original file line number Diff line number Diff line change
Expand Up @@ -28,7 +28,7 @@ def metatomic_calculator(device: torch.device):
"""Load a pretrained metatomic model for testing."""
return ase_calculator.MetatomicCalculator(
model=load_model(
"https://huggingface.co/lab-cosmo/pet-mad/resolve/main/models/pet-mad-latest.ckpt"
"https://huggingface.co/lab-cosmo/pet-mad/resolve/v1.1.0/models/pet-mad-v1.1.0.ckpt"
).export(),
device=device,
)
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2 changes: 1 addition & 1 deletion torch_sim/models/metatomic.py
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Expand Up @@ -103,7 +103,7 @@ def __init__(
)

if model == "pet-mad":
path = "https://huggingface.co/lab-cosmo/pet-mad/resolve/main/models/pet-mad-latest.ckpt"
path = "https://huggingface.co/lab-cosmo/pet-mad/resolve/v1.1.0/models/pet-mad-v1.1.0.ckpt"
self._model = load_model(path).export()
elif model.endswith(".ckpt"):
path = model
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