Hi all,
I'm trying to write a script to get the following actions done repetitively.
- Move atoms in a set in z direction
- Fix atoms in the set
- Run Forcite dynamics
- Write forces of the atoms in the set to a study table
- Remove the fixing of atoms
- And repeat the procedure from 1 to 5
Is it a possible task? I noticed the script to fix atoms in https://community.accelrys.com/message/1857#1857. But how to remove the fixity?
Kindly looking forward for your comments.
