ViewMol3D

ViewMol3D

ViewMol3D is a 3D OpenGL viewer for molecular structures from the output of quantum chemistry calculations.

Features

* Reads output of ab initio programs GAMESS (US), PC GAMESS and GAUSSIAN, semi-empirical programs MOPAC and AMPAC, and from XYZ format files
* Shows the geometry of a molecule
* Traces geometry optimization and MD trajectories
* Shows normal vibrations of a molecule as arrows
* Showes forces acting on each atom in a selected configuration
* Saves generated images in Bitmap/PNG formats

External links

* [http://www.meteo.mcgill.ca/andrew/vm3 ViewMol3D home page]


Wikimedia Foundation. 2010.

Игры ⚽ Нужен реферат?

Share the article and excerpts

Direct link
Do a right-click on the link above
and select “Copy Link”