RDKit
Open-source cheminformatics and machine learning.
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#include <Params.h>
Public Attributes | |
double | R_ij_starUnscaled |
double | epsilonUnscaled |
double | R_ij_star |
double | epsilon |
Definition at line 150 of file MMFF/Params.h.
double ForceFields::MMFF::MMFFVdWRijstarEps::epsilon |
Definition at line 155 of file MMFF/Params.h.
double ForceFields::MMFF::MMFFVdWRijstarEps::epsilonUnscaled |
Definition at line 153 of file MMFF/Params.h.
double ForceFields::MMFF::MMFFVdWRijstarEps::R_ij_star |
Definition at line 154 of file MMFF/Params.h.
double ForceFields::MMFF::MMFFVdWRijstarEps::R_ij_starUnscaled |
Definition at line 152 of file MMFF/Params.h.