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Improve handling of ElementRefs.
Test
#902:
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Minor cleanup.
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Cap dependency.
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Merge branch 'main' of github.com:materialyzeai/matgl
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Fix import regression.
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Clean up some doc.
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Centralize constants management with test for regression against scipy
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Remove useless check on pyg install.
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Bug fix for cache issues with MGLdataset on mfi data.
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Add optional MLflow experiment tracking for training
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feat: add optional MLflow experiment tracking for training
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Update doc for lammps.
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v4.0.3
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Update version and changelog.
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Fix for silent mismatch between dataset element list and model elemen…
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Fix for silent mismatch between dataset element list and model element list
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Fix for silent mismatch between dataset element list and model element list
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Simplify _dataset_element_types / _validate_element_types
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Fix for silent mismatch between dataset element list and model element list
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Read dataset element_types from converter; fix finetune notebooks
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Fix for silent mismatch between dataset element list and model element list
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fix: cast numpy int to Python int in compute_line_graph loop (#818)
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fix: cast numpy int to Python int in compute_line_graph loop
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fix: load MatPES datasets from JSONL files on HF
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