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9 #ifndef BALL_MOLMEC_COMMON_ASSIGNTYPES_H
10 #define BALL_MOLMEC_COMMON_ASSIGNTYPES_H
12 #ifndef BALL_CONCEPT_PROCESSOR_H
16 #ifndef BALL_MOLMEC_PARAMETER_ATOMTYPES_H
130 #endif // BALL_MOLMEC_COMMON_ASSIGNTYPES_H
HashSet< const Atom * > & getUnassignedAtoms()
Get the atoms, for which the force field setup failed.
Size getMaximumUnassignedAtoms() const
void setMaximumUnassignedAtoms(Size nr)
Size max_number_unassigned_atoms_
Only used for deriving interface.
StringHashMap< String > type_map_
AssignTypeNameProcessor(const String &filename, bool overwrite=false)
HashSet< const Atom * > unassigned_atoms_
Size getNumberOfUnassignedAtoms() const
Get the number of atoms, for which the force field setup failed.
AssignTypeProcessor(const AtomTypes &atom_types)