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Move FairChem to external model posture

good first issueGood for newcomersGood for newcomers

help wantedExtra attention is neededExtra attention is needed

Status: Open.

#431 In TorchSim/torch-sim;

· CompRhys opened on Jan 30, 2026

Move MatterSim to external model posture

good first issueGood for newcomersGood for newcomers

help wantedExtra attention is neededExtra attention is needed

Status: Open.

#430 In TorchSim/torch-sim;

· CompRhys opened on Jan 30, 2026

Move SevenNet to external model posture

good first issueGood for newcomersGood for newcomers

help wantedExtra attention is neededExtra attention is needed

Status: Open.

#429 In TorchSim/torch-sim;

· CompRhys opened on Jan 30, 2026

Move MACE to external model posture

good first issueGood for newcomersGood for newcomers

help wantedExtra attention is neededExtra attention is needed

Status: Open.

#428 In TorchSim/torch-sim;

· CompRhys opened on Jan 30, 2026

Wrapped/unwrapped positions produce different results

Status: Open.

#423 In TorchSim/torch-sim;

· chlwjd1234 opened on Jan 27, 2026

Re-enable nequip 3.13 tests, eventually

Status: Open.

#422 In TorchSim/torch-sim;

· orionarcher opened on Jan 26, 2026

Memory scaling estimate does not work well for non-periodic systems

enhancementNew feature or requestNew feature or request

Status: Open.

#416 In TorchSim/torch-sim;

· orionarcher opened on Jan 22, 2026

Add support for OrbMol and move to external model posture

enhancementNew feature or requestNew feature or request

Status: Open.

#398 In TorchSim/torch-sim;

· thomasloux opened on Jan 7, 2026

Feature suggestion: lifecycle hooks for user-defined callbacks during simulations

apiAPI design discussionsAPI design discussions

ecosystemComp-chem ecosystem relatedComp-chem ecosystem related

enhancementNew feature or requestNew feature or request

featureEntirely new features, not improvements to existing onesEntirely new features, not improvements to existing ones

Status: Open.

#397 In TorchSim/torch-sim;

· janosh opened on Jan 5, 2026

Portable batched neighbourt list

enhancementNew feature or requestNew feature or request

Status: Open.

#386 In TorchSim/torch-sim;

· venkatkapil24 opened on Dec 12, 2025

Remove last_permutation from SwapMCState initialization

bugSomething isn't workingSomething isn't working

Status: Open.

#379 In TorchSim/torch-sim;

· curtischong opened on Dec 10, 2025

Run tests on GPU

ml-eng-friendly

testsTest all the thingsTest all the things

Status: Open.

#371 In TorchSim/torch-sim;

· curtischong opened on Nov 30, 2025