abort() | BALL::DockingAlgorithm | virtual |
abort_ | BALL::DockingAlgorithm | protected |
calcConjugate_(ProteinIndex pro_idx) | BALL::GeometricFit | protected |
changeProteinOrientation_(System &system, Vector3 euler_ang) | BALL::GeometricFit | protected |
CONNOLLY enum value | BALL::GeometricFit | |
current_round_ | BALL::GeometricFit | protected |
destroy_() | BALL::GeometricFit | protected |
doPreTranslation_(ProteinIndex pro_idx) | BALL::GeometricFit | protected |
FFT_grid_a_ | BALL::GeometricFit | protected |
FFT_grid_b_ | BALL::GeometricFit | protected |
FFT_grid_lower_coord_ | BALL::GeometricFit | protected |
FFT_grid_lower_index_ | BALL::GeometricFit | protected |
FFT_grid_origin_ | BALL::GeometricFit | protected |
FFT_grid_size_index_ | BALL::GeometricFit | protected |
FFT_grid_upper_coord_ | BALL::GeometricFit | protected |
FFT_grid_upper_index_ | BALL::GeometricFit | protected |
FFTGridMulti_() | BALL::GeometricFit | protected |
findConnollySurfacePoints_(System &system, ProteinIndex pro_idx) | BALL::GeometricFit | protected |
findFTDockInsidePoints_(System &system, ProteinIndex pro_idx) | BALL::GeometricFit | protected |
findFTDockSurfacePoints_(System &system, ProteinIndex pro_idx) | BALL::GeometricFit | protected |
findInsidePoints_(System &system, ProteinIndex pro_idx) | BALL::GeometricFit | protected |
findVanDerWaalsSurfacePoints_(System &system, ProteinIndex pro_idx) | BALL::GeometricFit | protected |
FTDOCK enum value | BALL::GeometricFit | |
GeometricFit() | BALL::GeometricFit | |
GeometricFit(System &system1, System &system2) | BALL::GeometricFit | |
GeometricFit(Options &new_options) | BALL::GeometricFit | |
GeometricFit(System &system1, System &system2, Options &new_options) | BALL::GeometricFit | |
getConformationSet(Index total_number=0) | BALL::GeometricFit | virtual |
getGlobalPeak_(Peak_ *peak_list) | BALL::GeometricFit | protected |
getMassCenter_(System &system) | BALL::GeometricFit | protected |
getOrientation(Index con_num) const | BALL::GeometricFit | |
getProgress() const | BALL::GeometricFit | virtual |
getRadius_(System &system) | BALL::GeometricFit | protected |
getSeparation_(const Vector3 &mat_pos) | BALL::GeometricFit | protected |
getTranslation(Index con_num) const | BALL::GeometricFit | |
getTranslation_(const Vector3 &mat_pos) | BALL::GeometricFit | protected |
hasFinished() const | BALL::GeometricFit | virtual |
initFFTGrid_(ProteinIndex pro_idx) | BALL::GeometricFit | protected |
initGridSizes_() | BALL::GeometricFit | protected |
makeFFTGrid_(ProteinIndex pro_idx) | BALL::GeometricFit | protected |
optimizeGridSize_(int raw_size) | BALL::GeometricFit | protected |
options | BALL::GeometricFit | |
orientations_ | BALL::GeometricFit | protected |
pause() | BALL::DockingAlgorithm | virtual |
pause_ | BALL::DockingAlgorithm | protected |
peak_set_ | BALL::GeometricFit | protected |
pre_translation_a_ | BALL::GeometricFit | protected |
pre_translation_b_ | BALL::GeometricFit | protected |
proceed() | BALL::DockingAlgorithm | virtual |
PROTEIN_A enum value | BALL::GeometricFit | |
PROTEIN_B enum value | BALL::GeometricFit | |
ProteinIndex enum name | BALL::GeometricFit | |
radius_a_ | BALL::GeometricFit | protected |
radius_b_ | BALL::GeometricFit | protected |
setup(System &system1, System &system2, Options &new_options) | BALL::GeometricFit | virtual |
setup(System &system1, System &system2) | BALL::GeometricFit | virtual |
start() | BALL::GeometricFit | virtual |
SurfaceType enum name | BALL::GeometricFit | |
system1_ | BALL::DockingAlgorithm | protected |
system2_ | BALL::DockingAlgorithm | protected |
system_backup_a_ | BALL::GeometricFit | protected |
system_backup_b_ | BALL::GeometricFit | protected |
total_round_ | BALL::GeometricFit | protected |
translations_ | BALL::GeometricFit | protected |
VAN_DER_WAALS enum value | BALL::GeometricFit | |
wasAborted() const | BALL::DockingAlgorithm | inlinevirtual |
wasPaused() const | BALL::DockingAlgorithm | inlinevirtual |
~DockingAlgorithm() | BALL::DockingAlgorithm | inlinevirtual |
~GeometricFit() | BALL::GeometricFit | |