Chemical Data Processing Library C++ API - Version 1.1.1
|
This is the complete list of members for CDPL::ForceField::MMFF94VanDerWaalsParameterTable::Entry, including all inherited members.
Entry() | CDPL::ForceField::MMFF94VanDerWaalsParameterTable::Entry | |
Entry(unsigned int atom_type, double atom_pol, double eff_el_num, double fact_a, double fact_g, HDonorAcceptorType don_acc_type) | CDPL::ForceField::MMFF94VanDerWaalsParameterTable::Entry | |
getAtomicPolarizability() const | CDPL::ForceField::MMFF94VanDerWaalsParameterTable::Entry | |
getAtomType() const | CDPL::ForceField::MMFF94VanDerWaalsParameterTable::Entry | |
getEffectiveElectronNumber() const | CDPL::ForceField::MMFF94VanDerWaalsParameterTable::Entry | |
getFactorA() const | CDPL::ForceField::MMFF94VanDerWaalsParameterTable::Entry | |
getFactorG() const | CDPL::ForceField::MMFF94VanDerWaalsParameterTable::Entry | |
getHDonorAcceptorType() const | CDPL::ForceField::MMFF94VanDerWaalsParameterTable::Entry | |
operator bool() const | CDPL::ForceField::MMFF94VanDerWaalsParameterTable::Entry |