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apax-hub
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apax
A flexible and performant framework for training machine learning potentials.
https://apax.readthedocs.io
MIT License
18
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3
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use h5 file handle in jax md
#376
M-R-Schaefer
opened
1 day ago
0
Py 3.12 compatibility, rm chex and jaxtyping
#375
M-R-Schaefer
closed
3 days ago
1
[pre-commit.ci] pre-commit autoupdate
#374
pre-commit-ci[bot]
closed
4 days ago
0
ZBL empirical correction is broken
#373
lkkmpn
opened
5 days ago
2
Update README.md
#372
PythonFZ
closed
5 days ago
0
New config
#371
Tetracarbonylnickel
closed
1 week ago
0
Allow for python 3.12
#370
M-R-Schaefer
closed
2 days ago
1
[pre-commit.ci] pre-commit autoupdate
#369
pre-commit-ci[bot]
closed
1 week ago
0
Update pytest.yaml
#368
PythonFZ
closed
2 weeks ago
1
Fix spelling in docs
#367
M-R-Schaefer
opened
2 weeks ago
0
Fix Grammar in Docs
#366
MrJulEnergy
closed
2 weeks ago
1
[pre-commit.ci] pre-commit autoupdate
#365
pre-commit-ci[bot]
closed
2 weeks ago
0
Move project to uv instead of poetry
#364
M-R-Schaefer
opened
3 weeks ago
0
[pre-commit.ci] pre-commit autoupdate
#363
pre-commit-ci[bot]
closed
3 weeks ago
0
Flexible property prediction heads
#362
M-R-Schaefer
opened
3 weeks ago
0
PBP dataset performance enhancements
#361
M-R-Schaefer
closed
5 days ago
0
incompatibility with jax 0.4.35
#360
M-R-Schaefer
closed
2 days ago
1
[pre-commit.ci] pre-commit autoupdate
#359
pre-commit-ci[bot]
closed
1 month ago
0
Add atoms info when using ASECalculator
#358
MrJulEnergy
closed
2 weeks ago
0
[pre-commit.ci] pre-commit autoupdate
#357
pre-commit-ci[bot]
closed
1 month ago
0
prepare for ZnTrack v0.8.0 release
#356
PythonFZ
closed
2 days ago
0
Use `tensorflow`
#355
PythonFZ
closed
1 month ago
0
[pre-commit.ci] pre-commit autoupdate
#354
pre-commit-ci[bot]
closed
1 month ago
0
updated piecewise linear T schedule
#353
M-R-Schaefer
closed
1 month ago
1
implemented fix atom constraint and constraint API
#352
M-R-Schaefer
closed
1 month ago
1
[pre-commit.ci] pre-commit autoupdate
#351
pre-commit-ci[bot]
closed
2 months ago
0
fixed usage of multiple callbacks
#350
M-R-Schaefer
closed
2 months ago
1
removed black badge
#349
M-R-Schaefer
closed
2 months ago
0
ensemble batch eval fix, repulsion fix
#348
M-R-Schaefer
closed
2 months ago
1
batch evaluation broken for full ensembles
#347
M-R-Schaefer
closed
2 months ago
1
remove Black label from readme
#346
M-R-Schaefer
closed
2 months ago
1
[pre-commit.ci] pre-commit autoupdate
#345
pre-commit-ci[bot]
closed
2 months ago
0
Force features broken for shallow ensembles
#344
M-R-Schaefer
closed
2 months ago
0
new empirical correction interface, added exponential correction
#343
M-R-Schaefer
closed
2 months ago
1
AdEMAmix, Gradient clipping
#342
M-R-Schaefer
closed
2 months ago
1
Save the apax version in the `config.yaml`
#341
PythonFZ
opened
2 months ago
0
Add zntrack plot to Apax node
#340
M-R-Schaefer
opened
2 months ago
0
[pre-commit.ci] pre-commit autoupdate
#339
pre-commit-ci[bot]
closed
2 months ago
0
cleaned up gm implementation
#338
M-R-Schaefer
closed
2 months ago
0
fix calibration factors not available in calculator
#337
M-R-Schaefer
closed
2 months ago
0
[pre-commit.ci] pre-commit autoupdate
#336
pre-commit-ci[bot]
closed
2 months ago
0
add support for simple constraints in jax md
#335
M-R-Schaefer
closed
1 month ago
0
added w_init to template, updated default
#334
M-R-Schaefer
closed
2 months ago
0
cleaned up validation error messages
#333
M-R-Schaefer
closed
2 months ago
0
full ensemble fix, feature model fix
#332
M-R-Schaefer
closed
2 months ago
3
[pre-commit.ci] pre-commit autoupdate
#331
pre-commit-ci[bot]
closed
3 months ago
0
Adaptive BAL
#330
M-R-Schaefer
closed
2 months ago
1
Update README.md
#329
PythonFZ
closed
3 months ago
0
added uncertainty checks to jax md
#328
M-R-Schaefer
closed
3 months ago
5
CHange piece wise schedule to use duration instead of steps.
#327
M-R-Schaefer
closed
1 month ago
1
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