Classes | |
| class | AngleBendContrib |
| The angle-bend term for the Universal Force Field. More... | |
| class | BondStretchContrib |
| The bond-stretch term for the Universal Force Field. More... | |
| class | DistanceConstraintContrib |
| A distance range constraint modelled after a BondStretchContrib. More... | |
| class | vdWContrib |
| the van der Waals term for the Universal Force Field More... | |
| class | AtomicParams |
| class to store atomic parameters for the Universal Force Field More... | |
| class | ParamCollection |
| singleton class for retrieving UFF AtomParams More... | |
| class | TorsionAngleContrib |
| the torsion term for the Universal Force Field More... | |
Namespaces | |
| namespace | Params |
| namespace | Utils |
1.5.3