Gabedit

Summary

Gabedit
Gabedit.jpg
A screenshot of Gabedit 2.0.1
Developer(s)A.R. ALLOUCHE
Stable release
2.5.0 / July 10, 2017; 4 years ago (2017-07-10)
Repository
  • sourceforge.net/projects/gabedit/
Edit this at Wikidata
Operating systemOS Portable (Source code to work with many OS platforms)
TypeMolecular modelling
LicenseBSD License
Websitegabedit.sourceforge.net

Gabedit is a Graphical User Interface to GAMESS (US), Gaussian, MOLCAS, MOLPRO, MPQC, OpenMopac, PC GAMESS, ORCA and Q-Chem computational chemistry packages.

Major features

  • Builds molecules by atom, ring, group, amino acid and nucleoside.
  • Creates an input file for computational chemistry packages.
  • Reads output from the ab initio packages, and supports a number of other formats.
  • Displays molecular orbitals or electron density as contour plots or 3D grid plots and output to a number of graphical formats.
  • Animates molecular vibrations, contours, isosurfaces and rotation.

See also

External links

  • Gabedit official website