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Start implementing JANPA integration with Psi4
[molby/Molby.git] / Scripts / commands.rb
2022-10-02 Toshi NagataStart implementing JANPA integration with Psi4 blob | commitdiff
2022-10-01 Toshi NagataFix the horizontal scale of Show Energy window blob | commitdiff | diff to current
2022-09-24 Toshi NagataPsi4 import is improved (nalpha and nbeta are correctly... blob | commitdiff | diff to current
2022-09-18 Toshi NagataAPI of open_auxiliary_window is changed, so that they... blob | commitdiff | diff to current
2022-01-27 Toshi NagataConcatenate frames command is implemented. blob | commitdiff | diff to current
2021-12-20 Toshi NagataEmbedded scripts now contain magic comments to specify... blob | commitdiff | diff to current
2016-09-09 toshinagata1964Create MO Surface: default opacity is set to 0.8 instea... blob | commitdiff | diff to current
2016-09-07 toshinagata1964Show MO surface dialog now has 'Create Cube' button. blob | commitdiff | diff to current
2014-10-06 toshinagata1964The settings in the MO surface dialog is now kept after... blob | commitdiff | diff to current
2014-09-08 toshinagata1964In the 'Show MO surface' dialog, the labels for the... blob | commitdiff | diff to current
2014-07-28 toshinagata1964'Show MO Surface' is expanded so that the natural orbit... blob | commitdiff | diff to current
2014-07-02 toshinagata1964On exporting graphics, resolution and background color... blob | commitdiff | diff to current
2014-06-29 toshinagata1964The electron density surface can be drawn by create_sur... blob | commitdiff | diff to current
2014-06-26 toshinagata1964The MO information is now stored in the mbsf file. blob | commitdiff | diff to current
2014-06-19 toshinagata1964Show MO Surface dialog is updated (hopefully improved) blob | commitdiff | diff to current
2014-06-19 toshinagata1964Show MO Surface dialog is implemented. blob | commitdiff | diff to current
2014-06-18 toshinagata1964'Show Energy' window is implemented. blob | commitdiff | diff to current
2014-06-14 toshinagata1964On importing Gamess output, the energy values are read... blob | commitdiff | diff to current
2014-06-13 toshinagata1964Extra properties (assignable for each frame) are introd... blob | commitdiff | diff to current
2014-04-25 toshinagata1964Setting the 'Scratch' directory is sorted out. blob | commitdiff | diff to current
2014-03-21 toshinagata1964The menu commands in the Script menu were updated. blob | commitdiff | diff to current
2014-03-16 toshinagata1964'Show' menu is renamed to 'View'. 'Show...' menus are... blob | commitdiff | diff to current
2014-03-15 toshinagata1964Menu items are rearranged blob | commitdiff | diff to current
2014-03-15 toshinagata1964Script menu handling is improved blob | commitdiff | diff to current
2014-02-16 toshinagata1964'Create MO Cube' does not work when the molecule has... blob | commitdiff | diff to current
2014-02-16 toshinagata1964'proc' is replaced with 'lambda' for creating a Proc... blob | commitdiff | diff to current
2014-01-14 toshinagata1964Change GUI toolkit from wxWidgets 2.8.9 to wxWidgets... blob | commitdiff | diff to current
2011-09-01 toshinagata1964The MO info table is renamed to MO energy, and the... blob | commitdiff | diff to current
2010-05-11 toshinagata1964Flags for 'show graphite' and 'show periodic images... blob | commitdiff | diff to current
2010-03-20 toshinagata1964Some features of Dialog class are modified; Dialog... blob | commitdiff | diff to current
2010-03-13 toshinagata1964DialogItem class is implemented; Dialog#item and Dialog... blob | commitdiff | diff to current
2010-03-09 toshinagata1964The class RubyDialog is renamed to Dialog. All Molby... blob | commitdiff | diff to current
2010-02-23 toshinagata1964The Ruby command reorder_atoms is renamed to renumber_a... blob | commitdiff | diff to current
2010-01-21 toshinagata1964initial import blob | commitdiff | diff to current
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