Classes | |
| class | AmberEvaluation |
| A class for energetic evaluators of docking results using an AMBER force field as scoring function. More... | |
| class | ConformationSet |
| Data structure for conformation results. More... | |
| class | DockingAlgorithm |
| Interface class for docking algorithms. More... | |
| class | DockResult |
| Result of a (re)docking calculation. More... | |
| class | EnergeticEvaluation |
| Base class for energetic evaluators of docking results. More... | |
| class | ForceFieldEvaluation |
| Base class for energetic evaluators of docking results using a force field as scoring function. More... | |
| class | GeometricFit |
| GeometricFit This class is derived from class DockingAlgorithm. More... | |
| class | RandomEvaluation |
| A basis class for energetic evaluators of docking results. More... | |