| 1 - 2D Contour Map Viewer : a dialog allowing to plot 2D contour maps |
| 2 - Advanced Selection : to perform atom selection using various criteria |
| 3 - Log Window : the text (read-only) window giving various informations to the user, about what is being done by the program. |
| 4 - Object Tree
: gives the detail of the molecule (and its generated symmetry
equivalent molecules), of its fragments and atoms, and also of the
critical points loaded. |
 | 5 - 3D Isosurface Map
: it allows to configure and to run a computation with VMoPro of 3D
scalar field properties such as electron density, electrostatic potential or topological
analysis. The map written after such computation can be displayed and
managed using the "3D map manager" tool. |
 | 6 - 2D contour Map : it allows to configure and to run a computation with VMoPro of 2D contour map of various properties. The grid file containing the contour values written after such computation can be displayed using the "2D Contour Map Viewer". |
 | 7 - Electrostatic Moments Computation
: to compute electric dipoles and quadripoles of the molecule or of a
selection of atoms in the molecule. Computed moments can be displayed
and configured afterward using the "Electrostatic moments manager" |
| 8 - 3D Map Manager
: this tab widget allows to configure all 3D maps loaded, either
directly from the main menu, or after a computation using the "3D isosurface map" tool. |
| 9 - 3D Map Slice Manager : this tab widget allows to configure all the 2D map slices created to explore a 3D scalar field. |
| 10 - Summary Tree : a read-only dialog summarizing molecule names, loaded maps and running VMoPro computations. |
| 11 - 3D Map Color Chart
: this tool is used to colour a loaded scalar field using any other
loaded scalar field's values. It can be used for instance to colour a
0.001 e/A3 electron density map on the basis of the molecular
electrostatic potential. |
 | 12 - Atom Properties Editor : to check all properties of an atom |
 | 13 - Interaction Energy : a dialog window allowing to compute electrostatic interaction energy between two sets of atoms. |
 | 14 - Atom Move : a dialog window allowing to change precisely the position of a given atom. |
| 15 - Electrostatic moments manager : a tab window used to change the appearance of the computed electrostatic moments. |