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Fix: Old AtomicDielectricMACE models trained only on Dipoles were not properly supported.
Minimal changes to fix compile graph breaks for torch 2.8
…functions based on return_raw_model: bool
Fix return types of foundation checkpoint loaders for `return_raw_model=False`
lots of if/else on model_type
[DRAFT] Fix MACECalculator.results dict property names
Revert setting requires grad in data pipeline
Automatically create `Configuration.properties` from `--embedding_specs` dict, and automatically convert all `Configuration.properties` into `AtomicConfig.data` tensors.
Fix exit from epoch loop triggered by patience for distributed fits
Combining torch.compile with cueq
[DRAFT] Embedding of arbitrary per atom quantities
add finetuning for mh-1 and omol
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I think the tests are fine, they just timed out? |
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