Molecular graph

The molecular graph of a molecule for a certain density function consists of all gradient paths connecting critical points. Usually these paths are calculated for the charge density.
Of course, all critical points should be known if possible! The program will post a message if it suspects the existence of a critical point which is not yet known.

The gradient paths of a molecular graph belong to three different categories:

For all computed gradient paths, the program will present a record. Successfully computed gradient paths will be entered into the right hand side list.
The Options-button brings you to a dialog where you can manipulate the values used to solve the differential equations of the gradient paths.