Implement SimState.wrap_positions using pbc_wrap_batched#350
Merged
CompRhys merged 5 commits intoTorchSim:mainfrom Feb 5, 2026
Merged
Implement SimState.wrap_positions using pbc_wrap_batched#350CompRhys merged 5 commits intoTorchSim:mainfrom
CompRhys merged 5 commits intoTorchSim:mainfrom
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@thomasloux Could you please review this? I created a new branch without the test since my previous commits got messy after other changes in my fork. So I opened a clean PR. |
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Could you link the other PR for context? |
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Previous PR: #345 |
thomasloux
previously requested changes
Nov 24, 2025
torch_sim/state.py
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| """ | ||
| # TODO: implement a wrapping method | ||
| return self.positions | ||
| if not self.pbc: |
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now self.pbc is a Boolean (3,) shaped Tensor. So this expression won't work here. I don't think this piece of code should need a test, a static typing check would have catched that. replace with if not self.pbc.any()
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For reference of use of static check #339 |
CompRhys
dismissed
thomasloux’s stale review
I have addressed the blocking comment on this abandoned PR
thomasloux
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Feb 5, 2026
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Not sure the tests are super necessary, but good for me.
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Resolves #343