Difference between revisions of "GMIN"
Jump to navigation
Jump to search
import>Mp466 |
import>Csw34 |
||
| Line 5: | Line 5: | ||
These tutorials are under development. Please correct any mistakes you find and, of course, feel free to add more! |
These tutorials are under development. Please correct any mistakes you find and, of course, feel free to add more! |
||
| + | * [[Getting GMIN from the SVN repository]] |
||
* [[Global optimization of biomolecules using CHARMM]] |
* [[Global optimization of biomolecules using CHARMM]] |
||
* [[Global optimization of biomolecules using AMBER9]] |
* [[Global optimization of biomolecules using AMBER9]] |
||
Revision as of 10:15, 1 July 2008
A program for finding global minima and calculating thermodynamic properties from basin-sampling. The GMIN homepage is located here.
Tutorials
These tutorials are under development. Please correct any mistakes you find and, of course, feel free to add more!
- Getting GMIN from the SVN repository
- Global optimization of biomolecules using CHARMM
- Global optimization of biomolecules using AMBER9
- Global optimization of biomolecules using AMBER9 with Structural Restraints
- Optimization of ligand docking using AMBER9
Scripts
- makerestart: A bash script to automatically set up a GMIN restart run (for CHARMM users)