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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::MMFFOopCollection, including all inherited members.
getMMFFOop(const bool isMMFFs=false, const std::string &mmffOop="") | ForceFields::MMFF::MMFFOopCollection | static |
operator()(const unsigned int iAtomType, const unsigned int jAtomType, const unsigned int kAtomType, const unsigned int lAtomType) | ForceFields::MMFF::MMFFOopCollection | inline |