Avogadro is a user-friendly molecule builder and editor. It offers flexible rendering and a powerful plugin architecture for developers. The program supports interactive building of molecules with integrated molecular mechanics and a fragment database. Input generation for GAMESS or Gaussian calculations is provided. For visualization, the program supports crystallographic unit cells, isosurfaces and orbitals from Gaussian cubes and OpenDX.
What is new in this release:
- Fixed a bug in setting/retrieving user specified path to the Python interpreter
- Fixed bugs related to adding/removing programs in the MoleQueue submission dialog
- Prevent jobs from being submitted without programs in the selected MoleQueue queue