atom_array | BALL::FDPB | |
boundary_points_ | BALL::FDPB | protected |
calculateReactionFieldEnergy() const | BALL::FDPB | |
destroy() | BALL::FDPB | |
destroyGrids() | BALL::FDPB | |
energy_ | BALL::FDPB | protected |
eps_grid | BALL::FDPB | |
ERROR__ATOM_ARRAY_REQUIRED enum value | BALL::FDPB | |
ERROR__CANNOT_CREATE_ATOM_ARRAY enum value | BALL::FDPB | |
ERROR__CANNOT_CREATE_CHARGE_GRID enum value | BALL::FDPB | |
ERROR__CANNOT_CREATE_EPSILON_GRID enum value | BALL::FDPB | |
ERROR__CANNOT_CREATE_KAPPA_GRID enum value | BALL::FDPB | |
ERROR__CANNOT_CREATE_PHI_GRID enum value | BALL::FDPB | |
ERROR__CANNOT_CREATE_SAS_GRID enum value | BALL::FDPB | |
ERROR__EPSILON_GRID_REQUIRED enum value | BALL::FDPB | |
ERROR__ILLEGAL_VALUE_FOR_LOWER_UPPER enum value | BALL::FDPB | |
ERROR__NONE enum value | BALL::FDPB | |
ERROR__NOT_A_VECTOR_IN_UPPER_LOWER enum value | BALL::FDPB | |
ERROR__NOT_IMPLEMENTED enum value | BALL::FDPB | |
ERROR__OUT_OF_MEMORY enum value | BALL::FDPB | |
ERROR__PHI_GRID_REQUIRED enum value | BALL::FDPB | |
ERROR__SAS_GRID_REQUIRED enum value | BALL::FDPB | |
ERROR__SETUP_REQUIRED enum value | BALL::FDPB | |
ERROR__UNKNOWN enum value | BALL::FDPB | |
ERROR__UNKNOWN_BOUNDARY_CONDITION_TYPE enum value | BALL::FDPB | |
ERROR__UNKNOWN_CHARGE_DISTRIBUTION_METHOD enum value | BALL::FDPB | |
ERROR__UNKNOWN_DIELECTRIC_SMOOTHING_METHOD enum value | BALL::FDPB | |
error_code_ | BALL::FDPB | protected |
error_message_ | BALL::FDPB | protectedstatic |
ErrorCode enum name | BALL::FDPB | |
FastAtom typedef | BALL::FDPB | |
FDPB() | BALL::FDPB | |
FDPB(const FDPB &fdpb) | BALL::FDPB | |
FDPB(System &system) | BALL::FDPB | |
FDPB(Options &new_options) | BALL::FDPB | |
FDPB(System &system, Options &new_options) | BALL::FDPB | |
getEnergy() const | BALL::FDPB | |
getErrorCode() const | BALL::FDPB | |
getErrorMessage(Index error_code) | BALL::FDPB | static |
getNumberOfIterations() const | BALL::FDPB | |
getReactionFieldEnergy() const | BALL::FDPB | |
kappa_grid | BALL::FDPB | |
lower_ | BALL::FDPB | protected |
NUMBER_OF_ERRORS enum value | BALL::FDPB | |
number_of_iterations_ | BALL::FDPB | protected |
offset_ | BALL::FDPB | protected |
options | BALL::FDPB | |
phi_grid | BALL::FDPB | |
q_grid | BALL::FDPB | |
reaction_field_energy_ | BALL::FDPB | protected |
results | BALL::FDPB | |
SAS_grid | BALL::FDPB | |
setup(System &system) | BALL::FDPB | |
setup(System &system, Options &options) | BALL::FDPB | |
setupAtomArray(System &system) | BALL::FDPB | |
setupBoundary() | BALL::FDPB | |
setupEpsGrid(System &system) | BALL::FDPB | |
setupKappaGrid() | BALL::FDPB | |
setupPhiGrid() | BALL::FDPB | |
setupQGrid() | BALL::FDPB | |
setupSASGrid(System &system) | BALL::FDPB | |
solve() | BALL::FDPB | |
spacing_ | BALL::FDPB | protected |
upper_ | BALL::FDPB | protected |
use_offset_ | BALL::FDPB | protected |
~FDPB() | BALL::FDPB | virtual |