Chemical Data Processing Library C++ API - Version 1.1.1
CDPL::Descr::BCUTDescriptorCalculator Member List

This is the complete list of members for CDPL::Descr::BCUTDescriptorCalculator, including all inherited members.

AtomWeightFunction typedefCDPL::Descr::BCUTDescriptorCalculator
BCUTDescriptorCalculator()CDPL::Descr::BCUTDescriptorCalculatorinline
BCUTDescriptorCalculator(const Chem::MolecularGraph &molgraph, Math::DVector &descr)CDPL::Descr::BCUTDescriptorCalculator
calculate(const Chem::MolecularGraph &molgraph, Math::DVector &descr)CDPL::Descr::BCUTDescriptorCalculator
setAtomWeightFunction(const AtomWeightFunction &func)CDPL::Descr::BCUTDescriptorCalculator