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Compute n_edges memory scalers in atom-bounded chunks - #612

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TorchSim:mainfrom
avnoordenne:fix/chunked-n-edges-scalers
Oct 6, 2026
Merged

Compute n_edges memory scalers in atom-bounded chunks#612
CompRhys merged 2 commits into
TorchSim:mainfrom
avnoordenne:fix/chunked-n-edges-scalers

Rename max_atoms_per_pass to max_atoms_per_chunk

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Codecov / codecov/patch succeeded Oct 6, 2026 in 0s

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100.00% of diff hit (target 80.00%)

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