__init__(Configuration core_ph4_gen_cfg=CDPL.Pharm.Configuration.DEFAULT_CONFIG, Configuration env_ph4_gen_cfg=CDPL.Pharm.Configuration.DEFAULT_CONFIG) | CDPL.Pharm.InteractionPharmacophoreGenerator | |
__init__(InteractionPharmacophoreGenerator gen) | CDPL.Pharm.InteractionPharmacophoreGenerator | |
addExclusionVolumes(bool add) | CDPL.Pharm.InteractionPharmacophoreGenerator | |
addXVolumes (defined in CDPL.Pharm.InteractionPharmacophoreGenerator) | CDPL.Pharm.InteractionPharmacophoreGenerator | static |
assign(InteractionPharmacophoreGenerator gen) | CDPL.Pharm.InteractionPharmacophoreGenerator | |
coreEnvironment (defined in CDPL.Pharm.InteractionPharmacophoreGenerator) | CDPL.Pharm.InteractionPharmacophoreGenerator | static |
coreEnvironmentRadius (defined in CDPL.Pharm.InteractionPharmacophoreGenerator) | CDPL.Pharm.InteractionPharmacophoreGenerator | static |
corePharmacophore (defined in CDPL.Pharm.InteractionPharmacophoreGenerator) | CDPL.Pharm.InteractionPharmacophoreGenerator | static |
corePharmacophoreGenerator (defined in CDPL.Pharm.InteractionPharmacophoreGenerator) | CDPL.Pharm.InteractionPharmacophoreGenerator | static |
envPharmacophore (defined in CDPL.Pharm.InteractionPharmacophoreGenerator) | CDPL.Pharm.InteractionPharmacophoreGenerator | static |
envPharmacophoreGenerator (defined in CDPL.Pharm.InteractionPharmacophoreGenerator) | CDPL.Pharm.InteractionPharmacophoreGenerator | static |
exclusionVolumesAdded() | CDPL.Pharm.InteractionPharmacophoreGenerator | |
generate(Chem.MolecularGraph core, Chem.MolecularGraph tgt, Pharmacophore ia_pharm, bool extract_core_env, bool append=False) | CDPL.Pharm.InteractionPharmacophoreGenerator | |
getCoreEnvironment() | CDPL.Pharm.InteractionPharmacophoreGenerator | |
getCoreEnvironmentRadius() | CDPL.Pharm.InteractionPharmacophoreGenerator | |
getCorePharmacophore() | CDPL.Pharm.InteractionPharmacophoreGenerator | |
getCorePharmacophoreGenerator() | CDPL.Pharm.InteractionPharmacophoreGenerator | |
getEnvironmentPharmacophore() | CDPL.Pharm.InteractionPharmacophoreGenerator | |
getEnvironmentPharmacophoreGenerator() | CDPL.Pharm.InteractionPharmacophoreGenerator | |
getInteractionAnalyzer() | CDPL.Pharm.InteractionPharmacophoreGenerator | |
getInteractionMapping() | CDPL.Pharm.InteractionPharmacophoreGenerator | |
getObjectID() | CDPL.Pharm.InteractionPharmacophoreGenerator | |
interactionAnalyzer (defined in CDPL.Pharm.InteractionPharmacophoreGenerator) | CDPL.Pharm.InteractionPharmacophoreGenerator | static |
interactionMapping (defined in CDPL.Pharm.InteractionPharmacophoreGenerator) | CDPL.Pharm.InteractionPharmacophoreGenerator | static |
objectID (defined in CDPL.Pharm.InteractionPharmacophoreGenerator) | CDPL.Pharm.InteractionPharmacophoreGenerator | static |
setCoreEnvironmentRadius(float radius) | CDPL.Pharm.InteractionPharmacophoreGenerator | |