#include <assignTypes.h>
Inheritance diagram for AssignBaseProcessor:
Public Member Functions | |
void | setMaximumUnassignedAtoms (Size nr) |
Set the number of atoms, for which the setup of the forcefield can fail, until the setup() methods aborts and return false. | |
Size | getMaximumUnassignedAtoms () const |
Get the number of atoms, for which the setup of the forcefield can fail, until the setup() methods aborts and return false. | |
Size | getNumberOfUnassignedAtoms () const |
Get the number of atoms, for which the force field setup failed. | |
HashSet< const Atom * > & | getUnassignedAtoms () |
Get the atoms, for which the force field setup failed. | |
Protected Attributes | |
HashSet< const Atom * > | unassigned_atoms_ |
Size | max_number_unassigned_atoms_ |
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Get the number of atoms, for which the setup of the forcefield can fail, until the setup() methods aborts and return false.
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Set the number of atoms, for which the setup of the forcefield can fail, until the setup() methods aborts and return false. By default, there is no limit set. |