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TorchSim / torch-sim Public

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Vectorize atom index computation in L-BFGS optimizer#444

Merged

abhijeetgangan merged 3 commits intoTorchSim:mainTorchSim/torch-sim:mainfrom

falletta:lbfgs_vectorfalletta/torch-sim:lbfgs_vectorCopy head branch name to clipboard

Feb 6, 2026

Conversation Commits3 (3)Checks Files changed

Merged

Vectorize atom index computation in L-BFGS optimizer#444
abhijeetgangan merged 3 commits intoTorchSim:mainfrom
falletta:lbfgs_vector

Commits

Commits on Feb 6, 2026

vectorized compute_atom_idx for lbfgs

falletta
and
cursoragent
committed
Merge branch 'main' into lbfgs_vector
abhijeetgangan
authored
Merge branch 'main' into lbfgs_vector
falletta
authored

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