- show()
-
Displays the optimization history window for a molecule.
- showEnergy(status)
-
Sets the displays of the energy curve to status. status has
to be one of the integer constants
ON or OFF defined in the
viewmol module.
- showGradient(status)
-
Sets the displays of the gradient curve to status. status has
to be one of the integer constants
ON or OFF defined in the
viewmol module.
- showScales(status)
-
Sets the displays of the scales to status. status has
to be one of the integer constants
ON or OFF defined in
the viewmol module.
- animate(status)
-
Sets the animation of the optimization history to status. status
has to be one of the integer constants
ON or OFF defined in the
viewmol module.
- iteration([iteration])
-
Sets or returns the iteration displayed. iteration has to be an
integer between 0 and the number of optimization steps for this molecule.
- saveDrawing(format, filename)
-
Saves the energy level diagram to file. format has to be one of the
integer constants
TIFF, PNG, HPGL, or POSTSCRIPT defined
in the viewmol module, filename the name of the file the
drawing is saved to.
The optimization history window can be closed by deleting the history
object.
Jörg-Rüdiger Hill Fri Oct 31 14:19:21 CET 2003