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Improve CI with regards to data repo updates
CI/CD
Pipelines
data
enhancement
New feature or request
good first issue
Good for newcomers
help wanted
Extra attention is needed
#537
opened Jun 5, 2024 by
DanielKotik
Clean up cache entires after successfull merge of PR
CI/CD
Pipelines
#528
opened May 31, 2024 by
DanielKotik
New containers are added to the registry, which should not actually be different
CI/CD
Pipelines
#527
opened May 31, 2024 by
DanielKotik
Align Python versions througout MALA
CI/CD
Pipelines
documentation
Improvements or additions to documentation
enhancement
New feature or request
#526
opened May 31, 2024 by
DanielKotik
Use tempfile to handle LAMMPS and QE temporary files
enhancement
New feature or request
not critical
#525
opened May 31, 2024 by
RandomDefaultUser
GPU Graphs fail when used with batch size that is not divisor of data set size
bug
Something isn't working
not critical
#496
opened Dec 22, 2023 by
RandomDefaultUser
Zero validation data loss during hyperparameter optimization
question
Further information is requested
#492
opened Nov 3, 2023 by
nerkulec
Memory leak when running long GPU inferences
bug
Something isn't working
important
#487
opened Sep 28, 2023 by
RandomDefaultUser
Data scaling: API and documentation
api
documentation
Improvements or additions to documentation
#483
opened Sep 12, 2023 by
elcorto
Data scaling: row vs. column and naming of methods
documentation
Improvements or additions to documentation
#482
opened Sep 12, 2023 by
elcorto
Lazy loading with prefetching seems to hang in test suite
bug
Something isn't working
important
testing
#477
opened Aug 4, 2023 by
RandomDefaultUser
OpenPMD interface fails after LAMMPS usage
bug
Something isn't working
important
#476
opened Aug 4, 2023 by
RandomDefaultUser
Is it possible to simplify the installation with a package manager like conda?
enhancement
New feature or request
not critical
#470
opened Jul 28, 2023 by
jan-janssen
Implement Active Learning
enhancement
New feature or request
to do
#423
opened Feb 28, 2023 by
kyledmiller
Make learning rate rescale based on mini-batch size rather than # workers
#422
opened Feb 28, 2023 by
kyledmiller
Revert pydocstyle command once update is released
code quality
enhancement
New feature or request
not critical
#376
opened Dec 20, 2022 by
RandomDefaultUser
Stopping criterion when too much is pruned
bug
Something isn't working
not critical
#284
opened Mar 22, 2022 by
RandomDefaultUser
Docker image + Conda environment for use with GPUs
CI/CD
Pipelines
enhancement
New feature or request
#278
opened Mar 7, 2022 by
DanielKotik
Improve speed of cpu test workflow with GitHub's action strategy
CI/CD
Pipelines
enhancement
New feature or request
help wanted
Extra attention is needed
needs discussion
not critical
#272
opened Mar 2, 2022 by
DanielKotik
Combine Docker images, CPU+GPU?
CI/CD
Pipelines
help wanted
Extra attention is needed
needs discussion
not critical
#271
opened Mar 2, 2022 by
DanielKotik
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