Article ID: 1599 - Last Modified: September 20, 2011
Can I run a replica exchange job with $SCHRODINGER/desmond?
No, you should use $SCHRODINGER/multisim instead. You can use the Maestro panel to write out the input files. If you have an equilibrated system, you can delete the minimization and simulation stages up to the production stage in the msj file.
Type the words or phrases on which you would like to search, or click here to view a list of all
Knowledge Base articles