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Public Attributes | List of all members
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

Index BALL::MMFF94StretchBend::StretchBend::bend_index

Definition at line 37 of file MMFF94StretchBend.h.

double BALL::MMFF94StretchBend::StretchBend::energy

Definition at line 34 of file MMFF94StretchBend.h.

double BALL::MMFF94StretchBend::StretchBend::kba_ijk

Definition at line 32 of file MMFF94StretchBend.h.

double BALL::MMFF94StretchBend::StretchBend::kba_kji

Definition at line 33 of file MMFF94StretchBend.h.

Index BALL::MMFF94StretchBend::StretchBend::sbtijk

Definition at line 35 of file MMFF94StretchBend.h.

Index BALL::MMFF94StretchBend::StretchBend::stretch_i_j

Definition at line 36 of file MMFF94StretchBend.h.

Index BALL::MMFF94StretchBend::StretchBend::stretch_j_k

Definition at line 36 of file MMFF94StretchBend.h.