Commits · master · James Graham / pycgtool · GitLab

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Mar 22, 2017
- Add note to readme and documentation about the importance of validation · 577dfc6b
  James Graham authored Mar 22, 2017
  
  577dfc6b
Feb 21, 2017
- Added more detail on mapping-only-mode to documentation · 91730d94
  James Graham authored Feb 21, 2017
  
  91730d94
Jan 04, 2017
- Fix typo · 9ad05528
  James Graham authored Jan 4, 2017
  
  9ad05528
- Specify the selections needed in gmx gyrate · c51479c1
  David W. Wright authored Jan 4, 2017
  
  c51479c1
- Change to ensure use of Python script in the tutorial directory · f7383bf0
  David W. Wright authored Jan 4, 2017
  
  f7383bf0
- Edit names of atomistic trajectory files used in validation run · 8db23315
  David W. Wright authored Jan 4, 2017
  
  8db23315
- Add information on the template topology file provided and how to create a... · e0d1dbe7
  David W. Wright authored Jan 4, 2017
  e0d1dbe7
- Correctly format the filenames just added · 32d2d090
  David W. Wright authored Jan 4, 2017
  
  32d2d090
- Edit the tutorial text to agree with the provided atomistic trajectory filenames · 9f88329e
  David W. Wright authored Jan 4, 2017
  
  9f88329e
Dec 16, 2016
- CFG parser use OrderedDict · 5b04798e
  James Graham authored Dec 16, 2016
  5b04798e
Dec 14, 2016
- Update tutorial · fad8ceb0
  James Graham authored Dec 14, 2016
  
  fad8ceb0
- Mostly complete tutorial - needs rgyr section · f931a9df
  James Graham authored Dec 14, 2016
  
  f931a9df
- Rename --interactive to --advanced · 2656bfb5
  James Graham authored Dec 14, 2016
  
  2656bfb5
Aug 23, 2016
- Added optional bead charges to mapping file · 5cac7dcb
  James Graham authored Aug 23, 2016
  
  5cac7dcb
Aug 20, 2016
- Small updates to documentation · 8be6a9a7
  James Graham authored Aug 20, 2016
  
  8be6a9a7
- Add initial parts of tutorial to documentation · ab71cf62
  James Graham authored Aug 20, 2016
  
  ab71cf62
Jul 18, 2016
- Use random sampling instead of step in dump_values · 1e68bbb6
  James Graham authored Jul 18, 2016
  1e68bbb6
Jun 14, 2016
- Update and clean documentation · fa85ef1e
  James Graham authored Jun 14, 2016
  fa85ef1e
May 09, 2016
- Fixed sanitize.py · ffb87277
  James Graham authored May 9, 2016
  ffb87277
May 05, 2016
- Added documentation for readthedocs · 0e3ce469
  James Graham authored May 4, 2016
  
  0e3ce469
May 04, 2016
- Added documentation RST files to repo · d4d32ad4
  James Graham authored May 4, 2016
  d4d32ad4
Feb 25, 2016
- Added missing docstring and changed Sphinx theme · 7dfba1c3
  James Graham authored Feb 25, 2016
  
  7dfba1c3
Feb 24, 2016
- More setup of Sphinx documentation - html working · 4ac44c51
  James Graham authored Feb 24, 2016
  
  4ac44c51
Feb 23, 2016
- Added Sphinx docgen · c885519d
  James Graham authored Feb 23, 2016
  
  c885519d