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5 authors
  1. Sep 14, 2016
    • Richard Berger's avatar
      Allow writing input script from Python session · 6e3705f3
      Richard Berger authored 
      This implements the requested feature in issue #145. The `write_script`
method now gives you a way of dumping out all used commands into a
LAMMPS input script file.

Note: this also dumps all commands which are indirectly issued by PyLammps
      6e3705f3
  3. Aug 30, 2016
  5. Aug 24, 2016
    • Richard Berger's avatar
      Implemented optional C++ exceptions in Error class · e5c37bc7
      Richard Berger authored 
      These can be activated using the -DLAMMPS_EXCEPTIONS compiler flag.
It has no effect for regular execution. However, while using
it as a library, any issued command will capture the exception
and save its error message. This can be queried using the
lammps_has_error() and lammps_get_last_error_message() methods.

The Python wrapper checks these in order to rethrow these errors
as Python exceptions. See issue #146.

(cherry picked from commit 6c154bb0b67a13d38968bc42d31013b97f87db75)
      e5c37bc7
  7. Jul 22, 2016
  9. Jul 15, 2016
  11. May 31, 2016
  13. May 12, 2016
  15. Feb 15, 2016
  17. Dec 09, 2015
  19. Nov 21, 2015
  21. Sep 02, 2015
  23. Jul 02, 2015
  25. Mar 17, 2015
  27. Mar 13, 2015
  29. Jul 07, 2014
  31. Jun 07, 2014
  33. Jan 17, 2014
  35. Jun 10, 2013
  37. Mar 11, 2013
  39. Nov 07, 2012
  41. Oct 25, 2012
  43. Aug 16, 2012
  45. Aug 15, 2012
  47. Aug 14, 2012