Next: group_restraints() create
Up: MODELLER command reference
Previous: schedule.write() write
Contents
Index
The group_restraints class: restraints on atom groups
The group_restraints class holds classifications of atoms into
classes/groups, and restraints which act on certain atom groups. Such restraints
are used, for example, for the statistical potentials (such as DOPE) used for
loop modeling.
These restraints are only calculated if energy_data.dynamic_modeller is
set to True.
Subsections
Automatic builds
2013-06-11