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Pull requests: TorchSim/torch-sim

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Pull requests list

Accelerated ts.optimize by batching Frechet Cell Filter
#439 opened Feb 3, 2026 by falletta Loading…
1
Feature: Add fix symmetry constraint
#438 opened Feb 3, 2026 by danielzuegner Loading…
3 tasks done
More Spin and Charge tests
#434 opened Jan 31, 2026 by CompRhys • Draft
Accelerated ts.static + added scaling scripts
#427 opened Jan 30, 2026 by falletta Loading…
15
Implement lbfgs and bfgs keep-open
#365 opened Nov 26, 2025 by abhijeetgangan Loading…
3 tasks
19
Implement SimState.wrap_positions using pbc_wrap_batched
#350 opened Nov 22, 2025 by Praagnya Loading…
3 tasks done
1
5
Run ty in lint CI keep-open
#339 opened Nov 10, 2025 by janosh Loading…
2
Add CHGNet model support ecosystem Comp-chem ecosystem related models Model-related issues and PRs
#288 opened Oct 15, 2025 by brunocucco Loading…
17
Feature/thermodynamic integration feature Entirely new features, not improvements to existing ones keep-open
#263 opened Sep 25, 2025 by thomasloux Loading…
4 tasks
2
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