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67 Open 125 Closed
67 Open 125 Closed
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Issues list

Check if model is metatensor atomistic model? Atomistic-Models Related to the atomistic model code
#697 opened Jul 22, 2024 by frostedoyster
2
Unclear error in join bug Something isn't working Operations Related to metatensor-operations in Python
#694 opened Jul 18, 2024 by frostedoyster
2
Usage of metatensor.torch.learn.nn.Sequential Learn Related to metatensor-learn in Python
#693 opened Jul 17, 2024 by sovietdevil
1
Add documentation for LAMMPS & PLUMED integration documentation Improvements or additions to documentation
#690 opened Jul 15, 2024 by Luthaf
Allow to specify labels names in block_from_array good first issue Good for newcomers Operations Related to metatensor-operations in Python
#685 opened Jul 11, 2024 by Luthaf
1
Allow models to request additional input data from the engine Atomistic-Models Related to the atomistic model code
#682 opened Jul 9, 2024 by bananenpampe
7
Better API to execute arbitrary models with arbitrary outputs Atomistic-Models Related to the atomistic model code
#681 opened Jul 8, 2024 by Luthaf
2
Unclear usage of the metatensor.learn.nn.linear layer class documentation Improvements or additions to documentation Learn Related to metatensor-learn in Python Torch-API Related to the (Py)Torch interface
#677 opened Jul 5, 2024 by sovietdevil
1
metatensor-torch from PyPI doesn't work with the torch installation of conda Torch-API Related to the (Py)Torch interface
#665 opened Jun 21, 2024 by frostedoyster
6
Sorting an empty TensorBlock good first issue Good for newcomers Operations Related to metatensor-operations in Python Python-API Related to the Python bindings to "core"
#652 opened Jun 14, 2024 by PicoCentauri
1
Meta Issue: metatensor atomsitic models integration with simulation engines Atomistic-Models Related to the atomistic model code
#648 opened Jun 10, 2024 by Luthaf
2 of 11 tasks
1
Default argument for cell in metatensor.torch.atomistic.System?
#646 opened Jun 7, 2024 by frostedoyster
1
Combining extensions with the model Atomistic-Models Related to the atomistic model code
#638 opened May 28, 2024 by ceriottm
3
Rephrase the wording _wrap_ into _export_ for an MetatensorAtomisticModel documentation Improvements or additions to documentation good first issue Good for newcomers
#631 opened May 24, 2024 by PicoCentauri
Warn when creating/exporting a MetatensorAtomisticModel without units Atomistic-Models Related to the atomistic model code documentation Improvements or additions to documentation
#630 opened May 24, 2024 by PicoCentauri
Add split_by operation to split according to one of the Labels dimension Operations Related to metatensor-operations in Python
#627 opened May 22, 2024 by Luthaf
1
mts.torch.insert_dimension error for Labels of zero length Operations Related to metatensor-operations in Python
#600 opened May 2, 2024 by jwa7
allclose_raise gives ambiguous error message for keys in different order Operations Related to metatensor-operations in Python
#594 opened Apr 29, 2024 by sirmarcel
Consider re-implementing a from_weights class method for linear algebra models in metatensor-learn Learn Related to metatensor-learn in Python
#585 opened Apr 15, 2024 by jwa7
Fix the documentation preview
#576 opened Apr 10, 2024 by PicoCentauri
Add LabelsDict helper class Learn Related to metatensor-learn in Python
#568 opened Apr 3, 2024 by Luthaf
1
Allow for covariant normalization in metatensor.learn.nn.EquiLayerNorm Learn Related to metatensor-learn in Python
#567 opened Apr 3, 2024 by jwa7
Create a EquiModuleMap as the parent for Equi{...} metatensor-learn.nn modules Learn Related to metatensor-learn in Python
#566 opened Apr 3, 2024 by jwa7
Port equisolve's sample/feature selection to metatensor-learn Learn Related to metatensor-learn in Python
#558 opened Mar 26, 2024 by jwa7
1
@jwa7
save does not support pathlib objects bug Something isn't working good first issue Good for newcomers Python-API Related to the Python bindings to "core"
#548 opened Mar 12, 2024 by PicoCentauri
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