· Minor bugs were fixed
· All geometric changes can be undone and redone using the Undo and Redo (u/U or Ctrl z/Ctrl y)
· The user has complete control over the bonds displayed in a drawing.
· The drawing of the molecule atom by atom have been simplified.
· The drawing of the molecule fragment by fragment have been simplified.
· Gabedit read connectivities from gabedit, hin, pdb, mol2 and mol files.
· The user can set the value of the distance, bond angle and dihedral angle.
· A Molecular dynamics conformational search is implemented using a MM potential (Amber 99).
· A Molecular dynamics conformational search is implemented using a Semi-Empirical method (from Open Mopac or PCGamess).
· Migration from GDK drawing functions to Cairo: Cross-device Rendering for Vector Graphics.
· Cairo is now used for the XYplot gabedit widget(used by gabedit for draw spectrums).
· Cairo is now used for the geometry drawing window.
· Geometry can be exported in eps, ps, pdf or svg file.
· The curves of XYplot window can be exported in eps, ps, pdf or svg file.
· New tool for compute distance between 2 points on XYPlot window. "Control + shift button" can be used for do a zoom on XYPlot window.
· The new version of PCGamess (firefly) is now supported
· Minor bugs were fixe
· A Molecular dynamics conformational search is implemented using a MM potential (Amber 99).
· A Molecular dynamics conformational search is implemented using a Semi-Empirical potential (using MOPAC or PCGAMESS).
· One can optimize the geometry interactively using MOPAC or PCGamess semi-empirical method, from the Draw Geometry window
· Migration from GDK drawing functions to Cairo: Cross-device Rendering for Vector Graphics. Cairo is now used for the XYplot gabedit widget(used by gabedit for draw spectrums). Cairo is now used for the geometry drawing window.
· Geometry can be exported in eps, ps, pdf or svg file. The curves of XYplot window can be exported in eps, ps, pdf or svg file.
· New tool for compute distance between 2 points on XYPlot window. "Control+left button" can be used for do a zoom on XYPlot window.
· The new version of PC Gamess/Firefly is now supported