NAMD
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#include <structures.h>
Public Attributes | |
int32 | atom1 |
int32 | atom2 |
int32 | atom3 |
int32 | atom4 |
Index | dihedral_type |
Definition at line 61 of file structures.h.
int32 dihedral::atom1 |
Definition at line 63 of file structures.h.
Referenced by Parameters::assign_dihedral_index(), Molecule::atoms_1to4(), buildDihedralData(), Molecule::delete_qm_bonded(), DihedralElem::DihedralElem(), and ComputeHomeTuples< TholeElem, Thole, TholeValue >::loadTuples().
int32 dihedral::atom2 |
Definition at line 64 of file structures.h.
Referenced by Parameters::assign_dihedral_index(), Molecule::atoms_1to4(), buildDihedralData(), DihedralElem::DihedralElem(), dumpbench(), and ComputeHomeTuples< TholeElem, Thole, TholeValue >::loadTuples().
int32 dihedral::atom3 |
Definition at line 65 of file structures.h.
Referenced by Parameters::assign_dihedral_index(), Molecule::atoms_1to4(), buildDihedralData(), DihedralElem::DihedralElem(), dumpbench(), and ComputeHomeTuples< TholeElem, Thole, TholeValue >::loadTuples().
int32 dihedral::atom4 |
Definition at line 66 of file structures.h.
Referenced by Parameters::assign_dihedral_index(), Molecule::atoms_1to4(), buildDihedralData(), DihedralElem::DihedralElem(), dumpbench(), and ComputeHomeTuples< TholeElem, Thole, TholeValue >::loadTuples().
Index dihedral::dihedral_type |
Definition at line 67 of file structures.h.
Referenced by Parameters::assign_dihedral_index(), buildDihedralData(), DihedralElem::DihedralElem(), and dumpbench().