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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::MMFFDefCollection, including all inherited members.
getMMFFDef(const std::string &mmffDef="") | ForceFields::MMFF::MMFFDefCollection | static |
operator()(const unsigned int atomType) const | ForceFields::MMFF::MMFFDefCollection | inline |