Commits · 3de37a638289152b1fa92223ee3d7fbc2a77ba73 · Yusuf Hamied Department of Chemistry / Hunter Group / SSIPtools / SSIMPLEapps / phasecalculator · GitLab

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Jan 28, 2020
- add dvipng. · 3de37a63
  Mark Driver authored 5 years ago
  
  3de37a63
- update tex package. · 92f0fc48
  Mark Driver authored 5 years ago
  
  92f0fc48
- change tex package. · 4c16ffcd
  Mark Driver authored 5 years ago
  
  4c16ffcd
- update with minimum tex install. · f57ec826
  Mark Driver authored 5 years ago
  
  f57ec826
- update FGIP analysis methods; add imports to fgip runner. · 715bee50
  Mark Driver authored 5 years ago
  
  715bee50
- Merge branch 'master' of https://bitbucket.org/mdd31/phasecalculator · eda3b308
  Mark Driver authored 5 years ago
  
  eda3b308
- update to add polynomial IO methods and tests. · eeef97c7
  Mark Driver authored 5 years ago
  
  eeef97c7
- update path. · e5ab4438
  Mark Driver authored 5 years ago
  
  e5ab4438
- update call signature. · 136f274d
  Mark Driver authored 5 years ago
  
  136f274d
- update resource files. · 996ab414
  Mark Driver authored 5 years ago
  
  996ab414
Jan 27, 2020
- documentation. · 44049041
  Mark Driver authored 5 years ago
  
  44049041
- add solvent extractor and test. · dfa6aad0
  Mark Driver authored 5 years ago
  
  dfa6aad0
- update phasetransfer call arguments. · 65c68cc9
  Mark Driver authored 5 years ago
  
  65c68cc9
Jan 25, 2020
- potential fix based on https://github.com/nextcloud/docker/issues/380 · c1ba2037
  Mark Driver authored 5 years ago
  
  c1ba2037
- change to jre to install · d14066d0
  Mark Driver authored 5 years ago
  
  d14066d0
- update to which java in setup. · ee594f12
  Mark Driver authored 5 years ago
  
  ee594f12
- update to which java in setup. · e147cecb
  Mark Driver authored 5 years ago
  
  e147cecb
- update to which java in setup. · 5fdf301f
  Mark Driver authored 5 years ago
  
  5fdf301f
- update to install java in setup. · ecdeb076
  Mark Driver authored 5 years ago
  
  ecdeb076
Jan 24, 2020
- revert conda cache- bitbucket does not have this default. · 62c71df0
  Mark Driver authored 5 years ago
  
  62c71df0
- update pipeline config. · d0774710
  Mark Driver authored 5 years ago
  
  d0774710
- update to add methods to run phasetransfer calculation. · 710da5d5
  Mark Driver authored 5 years ago
  
  Inclusion of empty jar file.
  710da5d5
- update to environment.yml to include test fixtures and recommonmark. · 90e65b0c
  Mark Driver authored 5 years ago
  
  90e65b0c
- update caching for conda. · 24fa7ee1
  Mark Driver authored 5 years ago
  
  24fa7ee1
- update to add pip cache. · 9afb05c4
  Mark Driver authored 5 years ago
  
  9afb05c4
- update to add conda cache. · 58f81d57
  Mark Driver authored 5 years ago
  
  58f81d57
- Initial Bitbucket Pipelines configuration · 46943556
  Mark Driver authored 5 years ago
  
  46943556
- initial pipeline and environment for CI tests. · 780b9c0a
  Mark Driver authored 5 years ago
  
  780b9c0a
Jan 23, 2020
- update to add methods to gnerate input phase and solvent XML. · cec1d8f8
  Mark Driver authored 5 years ago
  
  cec1d8f8
- ignore compiled files. · e287ee15
  Mark Driver authored 5 years ago
  
  e287ee15
Jan 07, 2020
- update to add provisional module files. · f66c8f77
  Mark Driver authored 5 years ago
  
  These just contain logger set up. Actual documentation and impolementations are required.
  f66c8f77
- add init files for expected structure. · 6fb38e21
  Mark Driver authored 5 years ago
  
  6fb38e21
- Merge branch 'master' of https://bitbucket.org/mdd31/phasecalculator · 727340c6
  M.D. Driver authored 5 years ago
  
  727340c6
- initial README.md · 4f5d79a4
  Mark Driver authored 5 years ago
  
  4f5d79a4
- Creation of phasecalculator repository. · 32bcccb9
  M.D. Driver authored 5 years ago
  
  Designed to automate calculation of FGIPs, solvent similarity and VLE informatio n using SSIMPLE, pulling together analysis and calculation modules in a higher l evel repository
  32bcccb9