Software:Gabedit

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Gabedit
Gabedit.jpg
A screenshot of Gabedit 2.0.1
Developer(s)A.R. ALLOUCHE
Stable release
2.5.1 / July 27, 2021; 2 years ago (2021-07-27)
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