Draw & Edit Molecule¶
Introduction¶
Briefly explain that nearly every Gaussian calculation begins by constructing a molecular structure in GaussView.
GaussView Interface¶

Navigation Video¶
Mouse Controls¶
| Action | Mouse |
|---|---|
| Rotate | Left Click + Drag |
| Translate | Right Click + Drag |
| Zoom | Mouse Wheel |
Drawing Atoms¶
Explain atom selection and placement.
Drawing Bonds¶
Single, double, triple, aromatic bonds.
Editing Atoms¶
- Change element
- Replace atom
- Delete atom
Editing Bonds¶
- Bond order
- Delete bond
Rings and Fragments¶
Explain how predefined fragments accelerate molecule building.
Clean Structure¶
Describe automatic geometry cleanup.
Measuring Molecular Geometry¶
- Bond length
- Bond angle
- Dihedral angle
Saving the Molecule¶
- .gjf
- .com
- .mol
- .xyz