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Pull requests: metatensor/metatrain

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Pull requests list

Refactor CompositionModel
#593 opened May 13, 2025 by jwa7 • Draft
4 tasks
1
2
Implement ModelMetadata storing in checkpoints
#592 opened May 9, 2025 by abmazitov Loading…
5 of 7 tasks
4
PET: Scheduler factor
#591 opened May 9, 2025 by tulga-rdn Loading…
2
Render usage.sh with sphinx-gallery
#590 opened May 8, 2025 by PicoCentauri Loading…
9
Batchsize trainsize fix
#589 opened May 8, 2025 by MarkusFas Loading…
2 of 3 tasks
2
Don't access model.outputs but define a new function for it
#588 opened May 7, 2025 by Luthaf Loading…
4 tasks
Add general finetune option
#585 opened May 7, 2025 by PicoCentauri • Draft
1 of 2 tasks
4
Versioning
#580 opened May 7, 2025 by DavideTisi Loading…
2 of 4 tasks
13
Adds a multi property example
#578 opened May 7, 2025 by bananenpampe Loading…
1 task done
@PicoCentauri
1
Make LLPR module checkpoint-friendly
#554 opened Apr 16, 2025 by frostedoyster • Draft
4 tasks
1
Change per_atom -> sample_kind
#536 opened Apr 4, 2025 by jwa7 • Draft
4 tasks
Enable NanoPET for atomic-basis spherical targets
#527 opened Mar 21, 2025 by jwa7 Loading…
1 of 3 tasks
@ppegolo @jwa7
65
Fix combined dataloader
#519 opened Mar 13, 2025 by frostedoyster Loading…
2
Added functionality for fine-tuning the PET heads only
#517 opened Mar 11, 2025 by MarkusFas Loading…
4 tasks
9
Example polarizability for QM7x subset
#506 opened Feb 24, 2025 by ppegolo Loading…
NanoPET on basis
#505 opened Feb 24, 2025 by jwa7 • Draft
few changes to make the device/datatype work in the composition model
#502 opened Feb 23, 2025 by bananenpampe Loading…
1
Enable electron density learning
#491 opened Feb 16, 2025 by frostedoyster Loading…
1 of 2 tasks
Enable fast attention in nanoPET
#454 opened Jan 26, 2025 by frostedoyster Loading…
5
Add PhACE architecture
#434 opened Dec 17, 2024 by frostedoyster Loading…
11 tasks done
@frostedoyster
23
Treat all warnings as errors during core tests (?)
#323 opened Jul 28, 2024 by frostedoyster • Draft
3
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