Commits · v3.2.0 · AGOX / AGOX · GitLab

Sep 08, 2023
- Sparse GPR training on forces · c11e427b
  Nikolaj Rønne authored Sep 08, 2023 and Mads-Peter V. C. committed Sep 08, 2023
  
  View commits for tag v3.2.0 v3.2.0
  c11e427b
- Merge branch 'fix_descriptor_kwargs' into 'dev' · c028e191
  Mads-Peter V. C. authored Sep 08, 2023
  c028e191
- Fixed bug where `DescriptorBaseClass` takes kwargs and therefore subclasses... · b1c1ede5
  Mads-Peter V. C. authored Sep 08, 2023
  View commits for tag v3.1.2 v3.1.2
  b1c1ede5
Sep 07, 2023
- Merge branch 'docs_update' into 'dev' · a44977de
  Mads-Peter V. C. authored Sep 07, 2023
  a44977de
- Slightly prettified. · 94b2a558
  Mads-Peter V. C. authored Sep 07, 2023
  
  94b2a558
- acquisitor defined in correct place. · cc629c9d
  Mads-Peter V. C. authored Sep 07, 2023
  
  cc629c9d
- Included argparse import in scripts, updated installation instructions. Added... · 5ed221ea
  Mads-Peter V. C. authored Sep 07, 2023
  5ed221ea
Aug 31, 2023
- Added a doc-string. This is mainly to test something with gitlab. · 24b3c25a
  Mads-Peter V. C. authored Aug 31, 2023
  
  24b3c25a
- Merge branch 'pypi-fixes' into 'dev' · 7121fa97
  Mads-Peter V. C. authored Aug 31, 2023
  7121fa97
- Fixing Pypi · eaac87b6
  Nikolaj Rønne authored Aug 31, 2023 and Mads-Peter V. C. committed Aug 31, 2023
  
  eaac87b6
Aug 07, 2023
- Merge branch 'gpr_ray_tests' into 'dev' · d04b7b50
  Nikolaj Rønne authored Aug 07, 2023
  d04b7b50
- Added tests for checking that synchronization works correctly. · 161543c3
  Mads-Peter V. C. authored Aug 07, 2023 and Nikolaj Rønne committed Aug 07, 2023
  
  161543c3
- Merge branch 'bugfix_sgpr_make_sigma' into 'dev' · d8d3e67d
  Nikolaj Rønne authored Aug 07, 2023
  d8d3e67d
- Bugfix for `_make_local_sigma` method · c1a46fb7
  Mads-Peter V. C. authored Aug 07, 2023 and Nikolaj Rønne committed Aug 07, 2023
  
  c1a46fb7
Jul 18, 2023
- Merge branch 'ray_docs' into 'dev' · cb46187b
  Mads-Peter V. C. authored Jul 18, 2023
  cb46187b
- Updated changelog to reflect both changes from this branch and recent merges to dev (3.0.0). · 9836abf8
  Mads-Peter V. C. authored Jul 18, 2023
  
  9836abf8
- Ticked up version number. · bb39e3da
  Mads-Peter V. C. authored Jul 18, 2023
  
  View commits for tag v3.1.0 v3.1.0
  bb39e3da
- Removed unused import. · 86f00d32
  Mads-Peter V. C. authored Jul 18, 2023
  
  86f00d32
- Did some light clean up, type hints and doc strings. · 1ea021c9
  Mads-Peter V. C. authored Jul 18, 2023
  
  1ea021c9
- Removed post_analysis_methods as their functionality is replaced by filters. · 89b29060
  Mads-Peter V. C. authored Jul 18, 2023
  
  89b29060
- Merge branch 'dev' into ray_docs · 0e574a6b
  Mads-Peter V. C. authored Jul 18, 2023
  
  0e574a6b
- Merge branch 'stable' into dev · 168fe77e
  Mads-Peter V. C. authored Jul 18, 2023
  
  168fe77e
- Added FeatureDistanceFilter and wrote a small test and a usage example for the documentation. · 062c18ee
  Mads-Peter V. C. authored Jul 18, 2023
  
  062c18ee
- Added more documentation about parallel AGOX. · 3136244a
  Mads-Peter V. C. authored Jul 18, 2023
  
  3136244a
- Added from_atoms methods. · 445a7628
  Mads-Peter V. C. authored Jul 18, 2023
  
  445a7628
- Merge branch 'dev' into ray_docs · c4a548d3
  Mads-Peter V. C. authored Jul 18, 2023
  
  c4a548d3
Jul 12, 2023
- Merge branch 'sgpr_hyper_opt_fix' into 'dev' · 3124b3bf
  Nikolaj Rønne authored Jul 12, 2023
  3124b3bf
- Ticked up version number due to bug fix. · 5db7aea2
  Mads-Peter V. C. authored Jul 12, 2023
  
  5db7aea2
Jul 11, 2023
- Merge branch 'attempt-fix-test' into 'dev' · cc2bfe80
  Nikolaj Rønne authored Jul 11, 2023
  cc2bfe80
- Attempt fix test · c586811f
  Mads-Peter V. C. authored Jul 11, 2023 and Nikolaj Rønne committed Jul 11, 2023
  
  c586811f
Jul 10, 2023
- Changed Ray start up function slightly, to avoid multiple pprints. Changed... · f32470c1
  Mads-Peter V. C. authored Jul 10, 2023
  f32470c1
- Merge branch 'dev' of gitlab.com:agox/agox into dev · b0f6e8e6
  Mads-Peter V. C. authored Jul 10, 2023
  
  b0f6e8e6
- Debugging prints... · 0b1246ea
  Mads-Peter V. C. authored Jul 10, 2023
  
  0b1246ea
- Update .gitlab-ci.yml file · 56999d58
  Nikolaj Rønne authored Jul 10, 2023
  
  56999d58
- Update .gitlab-ci.yml file · e8b1f427
  Nikolaj Rønne authored Jul 10, 2023
  
  e8b1f427
- Merge branch 'dev-test-fix' into 'dev' · 1cf5e1d3
  Nikolaj Rønne authored Jul 10, 2023
  1cf5e1d3
- Added ray mark for pytest to run only tests that involve ray. · be9684ee
  Mads-Peter V. C. authored Jul 10, 2023 and Nikolaj Rønne committed Jul 10, 2023
  
  be9684ee
- Merge branch 'models-update' into 'dev' · 96565293
  Mads-Peter V. C. authored Jul 10, 2023
  96565293
- New Model API · 579df945
  Nikolaj Rønne authored Jul 10, 2023 and Mads-Peter V. C. committed Jul 10, 2023
  
  View commits for tag v3.0.0 v3.0.0
  579df945
- Merge branch 'docker-image' into 'dev' · 60256635
  Nikolaj Rønne authored Jul 10, 2023
  60256635