Commits · v0.3.0 · ccp5 / dlpoly-py

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Jan 25, 2022
- tag 0.3.0 · 6a9cd42c
  Alin Elena authored Jan 25, 2022
  
  View commits for tag v0.3.0 v0.3.0
  
  6a9cd42c
- fix field not finishing atom description block · 4fbd3d58
  Alin Elena authored Jan 25, 2022
  
  4fbd3d58
- Fix bug with molecule counting · 7eefd19d
  Jacob Wilkins authored Jan 25, 2022
  
  7eefd19d
Nov 26, 2021
- tag 0.2.9 · 32a94c27
  Alin Elena authored Nov 26, 2021
  
  View commits for tag v0.2.9 v0.2.9
  32a94c27
- Merge branch 'fix-nfold' into 'devel' · 2868d5c4
  Jacob Wilkins authored Nov 26, 2021
  2868d5c4
- Fix nfold · b735ee78
  Jacob Wilkins authored Nov 26, 2021
  
  b735ee78
- Merge branch 'test' into 'devel' · a8db1977
  Jacob Wilkins authored Nov 26, 2021
  a8db1977
- add exe · 99cdf9b5
  Alin Marin Elena authored Nov 26, 2021 and Jacob Wilkins committed Nov 26, 2021
  
  99cdf9b5
- f · 653ecbb3
  Alin Elena authored Nov 26, 2021
  
  653ecbb3
- add exe · 5e1a9d45
  Alin Elena authored Nov 26, 2021
  
  5e1a9d45
- tag 0.2.8 · f182fa68
  Alin Elena authored Nov 26, 2021
  
  View commits for tag v0.2.8 v0.2.8
  f182fa68
Nov 25, 2021
- Appease flake · e25aa8c5
  Jacob Wilkins authored Nov 25, 2021
  
  e25aa8c5
- Fix workdir · a659d460
  Jacob Wilkins authored Nov 25, 2021
  
  a659d460
- tag 0.2.7 · 4fdc498b
  Alin Elena authored Nov 25, 2021
  
  View commits for tag v0.2.7 v0.2.7
  4fdc498b
- Add defensive lines · bda13aad
  Jacob Wilkins authored Nov 25, 2021
  
  bda13aad
- tag 0.2.6 · e5d6f642
  Alin Elena authored Nov 25, 2021
  
  View commits for tag v0.2.6 v0.2.6
  e5d6f642
- Assign workdir to self · 7f5227c7
  Jacob Wilkins authored Nov 25, 2021
  
  7f5227c7
- tag 0.2.5 · eb7d9788
  Alin Elena authored Nov 25, 2021
  
  View commits for tag v0.2.5 v0.2.5
  eb7d9788
- Merge branch 'io-file-output' into 'devel' · 6b516943
  Alin Marin Elena authored Nov 25, 2021
  6b516943
- Io file output · 07545fb9
  Jacob Wilkins authored Nov 25, 2021
  
  07545fb9
- Merge branch 'default_name' into 'devel' · eb9c7111
  Alin Marin Elena authored Nov 25, 2021
  eb9c7111
- Default name · 22e5a6ec
  Jacob Wilkins authored Nov 25, 2021
  
  22e5a6ec
- up version 0.2.4 · 025777ec
  Alin Elena authored Nov 25, 2021
  
  View commits for tag v0.2.4 v0.2.4
  025777ec
- Merge branch 'fix-issue-40' into 'devel' · 40a248b0
  Alin Marin Elena authored Nov 25, 2021
  40a248b0
- Fix issue 40 · 390eb362
  Jacob Wilkins authored Nov 25, 2021
  
  390eb362
Sep 08, 2021
- version 0.2.3 · 26adac47
  Alin Elena authored Sep 08, 2021
  
  View commits for tag v0.2.3 v0.2.3
  26adac47
- add toml file · ff590bad
  Alin Elena authored Sep 08, 2021
  
  ff590bad
- fix wrong vals printed... temp · 59629efc
  Alin Elena authored Sep 08, 2021
  
  View commits for tag v0.2.2 v0.2.2
  59629efc
- fix wrong vals printed... temp · 57b1635e
  Alin Elena authored Sep 08, 2021
  
  View commits for tag v0.2.2-pre v0.2.2-pre
  57b1635e
Sep 07, 2021
- bump version · 029bf222
  Alin Elena authored Sep 07, 2021
  
  View commits for tag v0.2.1 v0.2.1
  029bf222
Jul 30, 2021
- Update tests to work · bfa19574
  Jacob Wilkins authored Jul 30, 2021
  
  bfa19574
- Update tests to work · b60fadbd
  Jacob Wilkins authored Jul 30, 2021
  
  b60fadbd
- Appease Flake8 · 6fa2b619
  Jacob Wilkins authored Jul 30, 2021
  
  6fa2b619
- Fix runtime printing · 68d89571
  Jacob Wilkins authored Jul 30, 2021
  
  68d89571
- Fix issue with title · 5cc39263
  Jacob Wilkins authored Jul 30, 2021
  
  5cc39263
- Add default output · 8d62a36a
  Jacob Wilkins authored Jul 30, 2021
  
  8d62a36a
- Fix issue with over-stripping · fa4f2333
  Jacob Wilkins authored Jul 30, 2021
  
  fa4f2333
- Skip control · 2c1dd8e3
  Jacob Wilkins authored Jul 30, 2021
  
  2c1dd8e3
- Revert change to notebook · d7708117
  Jacob Wilkins authored Jul 30, 2021
  
  d7708117
- Update to reflect new control · b016108b
  Jacob Wilkins authored Jul 30, 2021
  
  b016108b