Code

Add energy to dataset#24

Code

Merged

rousseab merged 19 commits intomainmila-iqia/diffusion_for_multi_scale_molecular_dynamics:mainfrom add_energy_to_datasetmila-iqia/diffusion_for_multi_scale_molecular_dynamics:add_energy_to_datasetCopy head branch name to clipboardApr 19, 2024

+500-391

Commits

Commits on Apr 17, 2024

• Turn off logging when using LAMMPS oracle.

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• A nicer progress bar.

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• Merge branch 'main' into lil_fixes

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• Merge branch 'sampling_callback' into lil_fixes

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• A nicer progress bar.

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• Reverting: two rich progressbars at once doesn't work. Too much work to fix.

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• Revert to tqdm. Rich cannot handle many progress bars.

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• Merge branch 'main' into add_energy_to_dataset

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• remove needless fashionmnist code

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Commits on Apr 18, 2024

• Refactored tests to avoid mocks. Add energy.

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• Fix broken test.

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Commits on Apr 19, 2024

• Utilities to generate fake data for tests.

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• Base class to generate fake data for tests.

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  7ceda0b

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• Refactored the data process tests to use the test base class.

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  68411b0

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• Fixed the flattening issue.

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• Fix imports and tools for testing.

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• More robust test of dataloaders.

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  c7d08b5

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• Added energy to the dataloader.

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  136cf2a

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• Add some logging so we know what is going on.

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