Gromacs
2022
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Helper type for discovering coupled constraints.
Public Member Functions | |
AtomsAdjacencyListElement (const int indexOfSecondConstrainedAtom, const int indexOfConstraint, const int signFactor) | |
Public Attributes | |
int | indexOfSecondConstrainedAtom_ |
The index of the other atom constrained to this atom. | |
int | indexOfConstraint_ |
The index of this constraint in the container of constraints. | |
int | signFactor_ |
A multiplicative factor that indicates the relative order of the atoms in the atom list. More... | |
int gmx::AtomsAdjacencyListElement::signFactor_ |
A multiplicative factor that indicates the relative order of the atoms in the atom list.
Used for computing the mass factor of this constraint relative to any coupled constraints.