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Pull requests: metatensor/metatrain

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Pull requests list

Ensure checkpoints are compact
#981 opened Dec 15, 2025 by johannes-spies • Draft
1
Fix huge MACE bug
#980 opened Dec 15, 2025 by pfebrer Loading…
8
Add experimental.graph2mat architecture
#979 opened Dec 15, 2025 by pfebrer Loading…
16 tasks
Added an experimental Muon optimizer to PET
#977 opened Dec 12, 2025 by abmazitov • Draft
1 of 5 tasks
13
Add CRPS scoring rule for the ensemble loss
#971 opened Dec 5, 2025 by ppegolo Loading…
1 of 3 tasks
14
Extract deep tokens from PET
#967 opened Dec 2, 2025 by jwa7 • Draft
5 tasks
1
Replace torch.nn.Module with metatensor.torch.learn.nn.Module
#938 opened Nov 21, 2025 by GardevoirX • Draft
5 tasks
13
get_generic_target_info: allow diferent num_subtargets for each irrep
#927 opened Nov 19, 2025 by pfebrer Loading…
5
Add PhACE architecture
#921 opened Nov 18, 2025 by frostedoyster Loading…
15 tasks done
54
Add Classifier model for transfer learning classification
#917 opened Nov 18, 2025 by Copilot AI Loading…
13 tasks done
@frostedoyster
62
Make documentation beginner-friendly for users without ML experience
#896 opened Nov 6, 2025 by Copilot AI Loading…
13 of 15 tasks
1
@frostedoyster
48
[BUG] Isolation of tests in pet
#882 opened Oct 31, 2025 by pfebrer Loading…
8
Add an easier way to integrate an MLIP-only architecture
#876 opened Oct 31, 2025 by frostedoyster Loading…
3 of 5 tasks
22
Fix the handling of num_epochs for restart and finetune contexts
#845 opened Oct 20, 2025 by jwa7 Loading…
1 of 5 tasks
21
Architecture coverage test
#803 opened Oct 8, 2025 by sofiia-chorna • Draft
17
Don't always re-train when creating the documentation
#797 opened Oct 8, 2025 by johannes-spies Loading…
4
Avoid redundant work in _compute_single_neighbor_list for full neighbor list
#788 opened Oct 8, 2025 by sirmarcel Loading…
3 of 5 tasks
2
chore(cache): for generating test outputs
#786 opened Oct 8, 2025 by HaoZeke Loading…
11
chore(dep): add sphinx-needs
#764 opened Oct 7, 2025 by HaoZeke • Draft
5
dpa3 architecture
#725 opened Aug 15, 2025 by littlepeachs Loading…
9 of 19 tasks
18
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