FFReader Class Reference

#include <ff_reader.hh>

Public Member Functions

 FFReader (const String &base_dir)
void SetPreprocessorDefinition (const String &def)
void ReadGromacsForcefield ()
ForcefieldPtr GetForcefield ()
void SetForcefield (ForcefieldPtr ff)
void ReadResidueDatabase (const String &basename)
void ReadITP (const String &basename)
void ReadCHARMMPRM (const String &basename)
void ReadCHARMMRTF (const String &basename)

Detailed Description

Definition at line 102 of file ff_reader.hh.


Constructor & Destructor Documentation

FFReader ( const String base_dir  ) 

Member Function Documentation

ForcefieldPtr GetForcefield (  )  [inline]

Definition at line 111 of file ff_reader.hh.

void ReadCHARMMPRM ( const String basename  ) 
void ReadCHARMMRTF ( const String basename  ) 
void ReadGromacsForcefield (  ) 
void ReadITP ( const String basename  ) 
void ReadResidueDatabase ( const String basename  ) 
void SetForcefield ( ForcefieldPtr  ff  )  [inline]

Definition at line 113 of file ff_reader.hh.

void SetPreprocessorDefinition ( const String def  )  [inline]

Definition at line 107 of file ff_reader.hh.


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