haconst.h File Reference

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Defines
#define	HACONST_H
#define	TRUE   1
#define	FALSE   0
#define	TNT_BASE_OFFSET   (1)
#define	TNT_BOUNDS_CHECK
#define	TNT_USE_REGIONS
#define	AbsFun(a)   (((a)<0)? -(a) : (a))
#define	MinFun(a, b)   (((a)<(b))? (a) : (b) )
#define	MaxFun(a, b)   (((a)>(b))? (a) : (b) )
Typedefs
typedef unsigned char	Byte
typedef int	Long
typedef int	int_4
typedef unsigned int	uint_4
typedef char	int_1
typedef unsigned char	uint_1
typedef short	int_2
typedef int	Subscript
Enumerations
enum	RunMode { RUN_FOREGROUND = 0, RUN_BACKGROUND = 1 }
Variables
const int	True = 1
const int	False = 0
const double	PI = 3.14159265358979323846
const double	BOHR_TO_ANG = 0.529177249
	Bohr to Angstroms.
const double	HARTREE_TO_EV = 27.21121
	HARTREE TO eV at 298K.
const double	HARTREE_TO_KT = 1059.642
	HARTREE TO kT at 298K.
const double	HARTREE_TO_JOULES = 4.3597482e-18
	Joules per Hartree.
const double	AU_TO_KG = 1.6605402e-27
	Kg per atomic unit mass.
const double	EV_TO_KT = HARTREE_TO_KT/HARTREE_TO_EV
	EV to kT at 298K.
const double	AVOG_NUM = 6.0221367e+23
	Avogadro constant.
const double	CAL_TO_JOULES = 4.184
	Joules per calorie.
const double	PLANCK = 6.6260755e-34
	Planck constant (Joules * sec).
const double	LIGHT_SPEED_CM = 2.99792458e+10
	Speed of light (cm/s).
const double	BOLTZ = 1.380658e-23
	Boltzmann constant (Joules per Kelvin).
const double	HARTREE_TO_KCAL = AVOG_NUM*HARTREE_TO_JOULES/(1000.0*CAL_TO_JOULES)
const double	KT_300_KCAL = 300.0 * BOLTZ * AVOG_NUM/(1000.0*CAL_TO_JOULES)
	kT in kcal/mol for 300K
const double	Rad2Deg = 180.0/PI
const double	Deg2Rad = PI/180.0
const int	ItemCount = 8
const int	AdvPickAtom = 0
const int	AdvPickNumber = 1
const int	AdvSelectCount = 2
const int	AdvName = 3
const int	AdvIdent = 4
const int	AdvClass = 5
const int	AdvImage = 6
const int	AdvPickCoord = 7

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Detailed Description

Application-wide Constants and Macros in HARLEM

Partially Derived from:

rasmol.h RasMol2 Molecular Graphics Roger Sayle, August 1995 Version 2.6

Author:

Igor Kurnikov

Date:

1999-2002

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