Gabedit
Gabedit is a Graphical User Interface to GAMESS (US), Gaussian, MOLCAS, MOLPRO, MPQC, OpenMopac, PC GAMESS, ORCA and Q-Chem computational chemistry packages.
![]() A screenshot of Gabedit 2.0.1 | |
Developer(s) | A.R. ALLOUCHE |
---|---|
Stable release | 2.5.0
/ July 10, 2017 |
Repository | ![]() |
Operating system | OS Portable (Source code to work with many OS platforms) |
Type | Molecular modelling |
License | BSD License |
Website | gabedit |
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.
gollark: Dell doesn't have to take that on directly but Apple certainly does.
gollark: What? They sell computers. Semiconductor stuff is literally *the* most capital-intensive industry.
gollark: In a working electoral system you would vote for more representative people, not arbitrarily rule out some classes of people based on some requirements.
gollark: If your "physical requirements" are physical fitness ones then that seems like a different argument.
gollark: Why not, if they're mentally sound?
See also
- List of molecular graphics systems
- PC GAMESS
- ORCA
- Quantum chemistry computer programs
- SAMSON
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