NAMD
Classes | Macros | Typedefs
Parameters.h File Reference
#include "parm.h"
#include "common.h"
#include "structures.h"
#include "strlib.h"
#include "MStream.h"
#include "SimParameters.h"
#include "GromacsTopFile.h"

Go to the source code of this file.

Classes

class  BondValue
 
class  AngleValue
 
struct  four_body_consts
 
class  DihedralValue
 
class  ImproperValue
 
struct  CrosstermData
 
class  CrosstermValue
 
class  GromacsPairValue
 
class  NonbondedExclValue
 
struct  vdw_val
 
struct  indexed_vdw_pair
 
struct  indexed_nbthole_pair
 
struct  nbthole_pair_value
 
struct  indexed_table_pair
 
class  Parameters
 

Macros

#define cbrt(x)   pow((double)x,(double)(1.0/3.0))
 
#define MAX_MULTIPLICITY   6
 
#define MAX_ATOMTYPE_CHARS   6
 
#define paraXplor   0
 
#define paraCharmm   1
 

Typedefs

typedef struct four_body_consts FourBodyConsts
 
typedef struct vdw_val VdwValue
 
typedef struct indexed_vdw_pair IndexedVdwPair
 
typedef struct indexed_nbthole_pair IndexedNbtholePair
 
typedef struct nbthole_pair_value NbtholePairValue
 
typedef struct indexed_table_pair IndexedTablePair
 

Macro Definition Documentation

#define cbrt (   x)    pow((double)x,(double)(1.0/3.0))

Copyright (c) 1995, 1996, 1997, 1998, 1999, 2000 by The Board of Trustees of the University of Illinois. All rights reserved.

Definition at line 31 of file Parameters.h.

Referenced by Parameters::get_vdw_params().

#define MAX_ATOMTYPE_CHARS   6
#define MAX_MULTIPLICITY   6
#define paraCharmm   1

Definition at line 77 of file Parameters.h.

Referenced by Parameters::Parameters().

#define paraXplor   0

Typedef Documentation

typedef struct vdw_val VdwValue