BALL::MMFF94StretchBend::StretchBend Struct Reference

#include <BALL/MOLMEC/MMFF94/MMFF94StretchBend.h>

Public Attributes
double	kba_ijk
double	kba_kji
double	energy
Index	sbtijk
Index	stretch_i_j
Index	stretch_j_k
Index	bend_index

Detailed Description

Definition at line 30 of file MMFF94StretchBend.h.

Member Data Documentation

bend_index

Index BALL::MMFF94StretchBend::StretchBend::bend_index

Definition at line 37 of file MMFF94StretchBend.h.

energy

double BALL::MMFF94StretchBend::StretchBend::energy

Definition at line 34 of file MMFF94StretchBend.h.

kba_ijk

double BALL::MMFF94StretchBend::StretchBend::kba_ijk

Definition at line 32 of file MMFF94StretchBend.h.

kba_kji

double BALL::MMFF94StretchBend::StretchBend::kba_kji

Definition at line 33 of file MMFF94StretchBend.h.

sbtijk

Index BALL::MMFF94StretchBend::StretchBend::sbtijk

Definition at line 35 of file MMFF94StretchBend.h.

stretch_i_j

Index BALL::MMFF94StretchBend::StretchBend::stretch_i_j

Definition at line 36 of file MMFF94StretchBend.h.

stretch_j_k

Index BALL::MMFF94StretchBend::StretchBend::stretch_j_k

Definition at line 36 of file MMFF94StretchBend.h.