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RDKit
Open-source cheminformatics and machine learning.
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This is the complete list of members for ForceFields::MMFF::MMFFTorCollection, including all inherited members.
getMMFFTor(const bool isMMFFs, const std::string &mmffTor="") | ForceFields::MMFF::MMFFTorCollection | static |
getMMFFTorParams(const std::pair< unsigned int, unsigned int > torType, const unsigned int iAtomType, const unsigned int jAtomType, const unsigned int kAtomType, const unsigned int lAtomType) | ForceFields::MMFF::MMFFTorCollection | inline |