RDKit
Open-source cheminformatics and machine learning.
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class to store MMFF parameters for bond stretching More...
#include <Params.h>
Public Attributes | |
double | kb |
double | r0 |
class to store MMFF parameters for bond stretching
Definition at line 81 of file MMFF/Params.h.
double ForceFields::MMFF::MMFFBond::kb |
Definition at line 83 of file MMFF/Params.h.
double ForceFields::MMFF::MMFFBond::r0 |
Definition at line 84 of file MMFF/Params.h.