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Pull requests: ACEsuit/mace

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Pull requests list

Add typed model outputs and a declarative observable specification reforge MACE v1 rewrite (Reforge) work item
#1723 opened Sep 11, 2026 by aacostadiaz Collaborator Loading…
1
update to graph_longrange v0.4.3
#1718 opened Sep 8, 2026 by WillBaldwin0 Collaborator Loading…
[codex] Fix gated block TorchScript export
#1717 opened Sep 8, 2026 by LOGO127 Contributor • Draft
Per-element (per-atom) force loss weighting
#1542 opened Aug 1, 2026 by mikyneb Loading…
Allow imports to work if openequivariance is installed but not running on supported GPU
#1534 opened Jul 22, 2026 by bernstei Collaborator Loading…
4
Add optional NVIDIA electrostatics backend for PolarMACE
#1524 opened Jul 15, 2026 by ilyes319 Contributor • Draft
4
Fixes bug preventing early stopping from exiting the training loop when not running in distributed mode (issue 1384)
#1502 opened Jun 16, 2026 by richardtomsett Loading…
1
accelerate stress calculations
#1498 opened Jun 10, 2026 by arnon-1 Collaborator Loading…
cast torch.Tensor to int type
#1497 opened Jun 10, 2026 by link89 Loading…
Small fix for stress calculation in low-dimensional systems
#1496 opened Jun 9, 2026 by dbidoggia Loading…
3
suppress TorchScript instance-level annotation warning
#1484 opened May 25, 2026 by chengjilai Loading…
1
7
fix linting
#1459 opened May 1, 2026 by alinelena Contributor Loading…
Update docs for lora finetuning
#1454 opened Apr 28, 2026 by hyjwpk Loading…
Add LoRA finetuning support for Contraction
#1453 opened Apr 28, 2026 by hyjwpk Loading…
6
Fix forces acting on constrained atoms when reading from extxyz database
#1448 opened Apr 23, 2026 by yantar92 Loading…
Add PolarMACE support to MaceTorchSimModel
#1441 opened Apr 14, 2026 by orionarcher Loading…
6 of 7 tasks
2
Remove int to int cast
#1431 opened Apr 3, 2026 by n-gao Loading…
Fix wandb handling of functions in arguement
#1402 opened Mar 7, 2026 by Pragalbhv Loading…
1
Fix non-periodic cell construction in get_neighborhood bug Something isn't working
#1395 opened Mar 3, 2026 by LarsSchaaf Collaborator • Draft
13
Fix wandb logging on rank>0 and add eval debug instrumentation
#1391 opened Mar 2, 2026 by ilyes319 Contributor Loading…
1 of 2 tasks
Partial hessian
#1338 opened Jan 24, 2026 by Phorbol Loading…
eval_configs: fix node energies bug, simplify force handling
#1327 opened Jan 9, 2026 by ThomasWarford Contributor Loading…
1
fix readme
#1326 opened Jan 8, 2026 by miluchen Loading…
1
support specific files by glob
#1313 opened Dec 24, 2025 by link89 Loading…
fix unused parameters error for distributed training with multihead
#1311 opened Dec 18, 2025 by bernstei Collaborator Loading…
1
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