1 #ifndef BALL_STRUCTURE_DISULFIDBONDPROCESSOR_H 2 #define BALL_STRUCTURE_DISULFIDBONDPROCESSOR_H 4 #ifndef BALL_CONCEPT_PROCESSOR_H 8 #ifndef BALL_KERNEL_SYSTEM_H 63 virtual bool finish();
83 bool connect(
Atom* atom1,
Atom* atom2,
bool toggle =
false);
86 bool connect(
Residue* residue1,
Residue* residue2,
bool toggle =
false);
92 bool disconnect(
Atom* atom1,
Atom* atom2);
106 #endif // BALL_STRUCTURE_DISULFIDBONDPROCESSOR_H std::pair< Residue *, Residue * > DisulfidBond
DisulfidBonds sulfur_bridges_
DisulfidBonds & getDisulfidBonds()
Return the vector of disulfid bonds.
const DisulfidBonds & getDisulfidBonds() const
Return the vector of disulfid bonds, const variant.
std::set< DisulfidBond > DisulfidBonds
Size getNumberOfDetectedDisulfidBonds()
Return the number of detected disulfid bonds.
#define BALL_CREATE(name)