ForceFields::MMFF::MMFFVdW Class Reference

class to store MMFF parameters for non-bonded Van der Waals More...

#include <Params.h>

Public Attributes
double	alpha_i
double	N_i
double	A_i
double	G_i
double	R_star
std::uint8_t	DA

Detailed Description

class to store MMFF parameters for non-bonded Van der Waals

Definition at line 133 of file MMFF/Params.h.

Member Data Documentation

A_i

double ForceFields::MMFF::MMFFVdW::A_i

Definition at line 137 of file MMFF/Params.h.

alpha_i

double ForceFields::MMFF::MMFFVdW::alpha_i

Definition at line 135 of file MMFF/Params.h.

DA

std::uint8_t ForceFields::MMFF::MMFFVdW::DA

Definition at line 140 of file MMFF/Params.h.

G_i

double ForceFields::MMFF::MMFFVdW::G_i

Definition at line 138 of file MMFF/Params.h.

N_i

double ForceFields::MMFF::MMFFVdW::N_i

Definition at line 136 of file MMFF/Params.h.

R_star

double ForceFields::MMFF::MMFFVdW::R_star

Definition at line 139 of file MMFF/Params.h.

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The documentation for this class was generated from the following file:

• MMFF/Params.h