IMP
2.0.0
The Integrative Modeling Platform
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A connection (bond, angle, dihedral) between some number of endpoints.
#include <IMP/atom/charmm_topology.h>
Public Member Functions | |
CHARMMConnection (const IMP::Strings &atoms) | |
CHARMMConnection (base::Vector< CHARMMBondEndpoint > endpoints) | |
Atoms | get_atoms (const CHARMMResidueTopology *current_residue, const CHARMMResidueTopology *previous_residue, const CHARMMResidueTopology *next_residue, const std::map< const CHARMMResidueTopology *, Hierarchy > &resmap) const |
Map the bond to a list of Atom particles. | |
bool | get_contains_atom (std::string name) const |
const IMP::atom::CHARMMBondEndpoint & | get_endpoint (unsigned int i) const |
void | show (std::ostream &out=std::cout) const |
Protected Attributes | |
base::Vector< CHARMMBondEndpoint > | endpoints_ |
Definition at line 92 of file charmm_topology.h.
bool IMP::atom::CHARMMConnection< D >::get_contains_atom | ( | std::string | name | ) | const |
Definition at line 117 of file charmm_topology.h.