calculateScore() (defined in VanDerWaals) | VanDerWaals | [virtual] |
CALCULATION__FULL_LJ_POTENTIAL enum value | VanDerWaals | |
CALCULATION__SOFTENED_LJ_POTENTIAL_LOG enum value | VanDerWaals | |
CALCULATION__SOFTENED_LJ_POTENTIAL_SIMPLE enum value | VanDerWaals | |
CalculationMethod enum name | VanDerWaals | |
clear() (defined in VanDerWaals) | VanDerWaals | [virtual] |
hydrogen_bond_ (defined in VanDerWaals) | VanDerWaals | [protected] |
is_hydrogen_bond_ (defined in VanDerWaals) | VanDerWaals | [protected] |
lennard_jones_ (defined in VanDerWaals) | VanDerWaals | [protected] |
non_bonded_ (defined in VanDerWaals) | VanDerWaals | [protected] |
number_of_1_4_ (defined in VanDerWaals) | VanDerWaals | [protected] |
number_of_h_bonds_ (defined in VanDerWaals) | VanDerWaals | [protected] |
setup() (defined in VanDerWaals) | VanDerWaals | [virtual] |
VanDerWaals() (defined in VanDerWaals) | VanDerWaals | |
VanDerWaals(ScoringFunction &sf) (defined in VanDerWaals) | VanDerWaals | |
VanDerWaals(ScoringComponent &sc) (defined in VanDerWaals) | VanDerWaals | |
~VanDerWaals() (defined in VanDerWaals) | VanDerWaals | [virtual] |