applications/staticProps/StaticPropsCmd.h

/* StaticPropsCmd.h */

/* File autogenerated by gengetopt version 2.16  */

#ifndef STATICPROPSCMD_H
#define STATICPROPSCMD_H

/* If we use autoconf.  */
#ifdef HAVE_CONFIG_H
#include "config.h"
#endif

#ifdef __cplusplus
extern "C" {
#endif /* __cplusplus */

#ifndef CMDLINE_PARSER_PACKAGE
#define CMDLINE_PARSER_PACKAGE "StaticProps"
#endif

#ifndef CMDLINE_PARSER_VERSION
#define CMDLINE_PARSER_VERSION "1.00"
#endif

struct gengetopt_args_info
{
  char * input_arg;     /* input dump file.  */
  char * input_orig;    /* input dump file original value given at command line.  */
  char * output_arg;    /* output file name.  */
  char * output_orig;   /* output file name original value given at command line.  */
  int step_arg; /* process every n frame (default='1').  */
  char * step_orig;     /* process every n frame original value given at command line.  */
  int nrbins_arg;       /* number of bins for distance (default='100').  */
  char * nrbins_orig;   /* number of bins for distance original value given at command line.  */
  int nbins_x_arg;      /* number of bins in x axis (default='100').  */
  char * nbins_x_orig;  /* number of bins in x axis original value given at command line.  */
  int nbins_y_arg;      /* number of bins in y axis (default='100').  */
  char * nbins_y_orig;  /* number of bins in y axis original value given at command line.  */
  int nanglebins_arg;   /* number of bins for cos(angle) (default='50').  */
  char * nanglebins_orig;       /* number of bins for cos(angle) original value given at command line.  */
  double length_arg;    /* maximum length (Defaults to 1/2 smallest length of first frame).  */
  char * length_orig;   /* maximum length (Defaults to 1/2 smallest length of first frame) original value given at command line.  */
  int LegendreL_arg;    /* Order of Legendre Polynomial (used for Bond Order calculations).  */
  char * LegendreL_orig;        /* Order of Legendre Polynomial (used for Bond Order calculations) original value given at command line.  */
  double rcut_arg;      /* cutoff radius (rcut).  */
  char * rcut_orig;     /* cutoff radius (rcut) original value given at command line.  */
  double zoffset_arg;   /* Where to set the zero for the slab_density calculation (default='0').  */
  char * zoffset_orig;  /* Where to set the zero for the slab_density calculation original value given at command line.  */
  char * sele1_arg;     /* select the first stuntdouble set.  */
  char * sele1_orig;    /* select the first stuntdouble set original value given at command line.  */
  char * sele2_arg;     /* select the second stuntdouble set.  */
  char * sele2_orig;    /* select the second stuntdouble set original value given at command line.  */
  char * sele3_arg;     /* select the third stuntdouble set.  */
  char * sele3_orig;    /* select the third stuntdouble set original value given at command line.  */
  char * refsele_arg;   /* select reference (use and only use with --gxyz).  */
  char * refsele_orig;  /* select reference (use and only use with --gxyz) original value given at command line.  */
  char * molname_arg;   /* molecule name.  */
  char * molname_orig;  /* molecule name original value given at command line.  */
  int begin_arg;        /* begin internal index.  */
  char * begin_orig;    /* begin internal index original value given at command line.  */
  int end_arg;  /* end internal index.  */
  char * end_orig;      /* end internal index original value given at command line.  */
  
  int help_given ;      /* Whether help was given.  */
  int version_given ;   /* Whether version was given.  */
  int input_given ;     /* Whether input was given.  */
  int output_given ;    /* Whether output was given.  */
  int step_given ;      /* Whether step was given.  */
  int nrbins_given ;    /* Whether nrbins was given.  */
  int nbins_x_given ;   /* Whether nbins_x was given.  */
  int nbins_y_given ;   /* Whether nbins_y was given.  */
  int nanglebins_given ;        /* Whether nanglebins was given.  */
  int length_given ;    /* Whether length was given.  */
  int LegendreL_given ; /* Whether LegendreL was given.  */
  int rcut_given ;      /* Whether rcut was given.  */
  int zoffset_given ;   /* Whether zoffset was given.  */
  int sele1_given ;     /* Whether sele1 was given.  */
  int sele2_given ;     /* Whether sele2 was given.  */
  int sele3_given ;     /* Whether sele3 was given.  */
  int refsele_given ;   /* Whether refsele was given.  */
  int molname_given ;   /* Whether molname was given.  */
  int begin_given ;     /* Whether begin was given.  */
  int end_given ;       /* Whether end was given.  */
  int bo_given ;        /* Whether bo was given.  */
  int gofr_given ;      /* Whether gofr was given.  */
  int r_theta_given ;   /* Whether r_theta was given.  */
  int r_omega_given ;   /* Whether r_omega was given.  */
  int theta_omega_given ;       /* Whether theta_omega was given.  */
  int gxyz_given ;      /* Whether gxyz was given.  */
  int p2_given ;        /* Whether p2 was given.  */
  int rp2_given ;       /* Whether rp2 was given.  */
  int scd_given ;       /* Whether scd was given.  */
  int density_given ;   /* Whether density was given.  */
  int slab_density_given ;      /* Whether slab_density was given.  */
  int hxy_given ;       /* Whether hxy was given.  */

  int staticProps_group_counter; /* counter for group staticProps */
} ;

int cmdline_parser (int argc, char * const *argv, struct gengetopt_args_info *args_info);
int cmdline_parser2 (int argc, char * const *argv, struct gengetopt_args_info *args_info, int override, int initialize, int check_required);
int cmdline_parser_file_save(const char *filename, struct gengetopt_args_info *args_info);

void cmdline_parser_print_help(void);
void cmdline_parser_print_version(void);

void cmdline_parser_init (struct gengetopt_args_info *args_info);
void cmdline_parser_free (struct gengetopt_args_info *args_info);

int cmdline_parser_required (struct gengetopt_args_info *args_info, const char *prog_name);


#ifdef __cplusplus
}
#endif /* __cplusplus */
#endif /* STATICPROPSCMD_H */
Revision:	1039
Committed:	Tue Sep 19 21:14:11 2006 UTC (19 years, 1 month ago) by gezelter
Content type:	text/plain
File size:	5881 byte(s)
Log Message:	Working on BondOrderParameter
#	User	Rev	Content
1	tim	311	/* StaticPropsCmd.h */
2	tim	310
3	gezelter	929	/* File autogenerated by gengetopt version 2.16 */
4	tim	310
5			#ifndef STATICPROPSCMD_H
6			#define STATICPROPSCMD_H
7
8			/* If we use autoconf. */
9			#ifdef HAVE_CONFIG_H
10			#include "config.h"
11			#endif
12
13			#ifdef __cplusplus
14			extern "C" {
15			#endif /* __cplusplus */
16
17			#ifndef CMDLINE_PARSER_PACKAGE
18	tim	311	#define CMDLINE_PARSER_PACKAGE "StaticProps"
19	tim	310	#endif
20
21			#ifndef CMDLINE_PARSER_VERSION
22			#define CMDLINE_PARSER_VERSION "1.00"
23			#endif
24
25	tim	543	struct gengetopt_args_info
26			{
27			char * input_arg; /* input dump file. */
28	gezelter	929	char * input_orig; /* input dump file original value given at command line. */
29	tim	543	char * output_arg; /* output file name. */
30	gezelter	929	char * output_orig; /* output file name original value given at command line. */
31	tim	543	int step_arg; /* process every n frame (default='1'). */
32	gezelter	929	char * step_orig; /* process every n frame original value given at command line. */
33	tim	543	int nrbins_arg; /* number of bins for distance (default='100'). */
34	gezelter	929	char * nrbins_orig; /* number of bins for distance original value given at command line. */
35	xsun	967	int nbins_x_arg; /* number of bins in x axis (default='100'). */
36	xsun	955	char * nbins_x_orig; /* number of bins in x axis original value given at command line. */
37	xsun	967	int nbins_y_arg; /* number of bins in y axis (default='100'). */
38	xsun	955	char * nbins_y_orig; /* number of bins in y axis original value given at command line. */
39	tim	543	int nanglebins_arg; /* number of bins for cos(angle) (default='50'). */
40	gezelter	929	char * nanglebins_orig; /* number of bins for cos(angle) original value given at command line. */
41	tim	543	double length_arg; /* maximum length (Defaults to 1/2 smallest length of first frame). */
42	gezelter	929	char * length_orig; /* maximum length (Defaults to 1/2 smallest length of first frame) original value given at command line. */
43	gezelter	1039	int LegendreL_arg; /* Order of Legendre Polynomial (used for Bond Order calculations). */
44			char * LegendreL_orig; /* Order of Legendre Polynomial (used for Bond Order calculations) original value given at command line. */
45			double rcut_arg; /* cutoff radius (rcut). */
46			char * rcut_orig; /* cutoff radius (rcut) original value given at command line. */
47	gezelter	929	double zoffset_arg; /* Where to set the zero for the slab_density calculation (default='0'). */
48			char * zoffset_orig; /* Where to set the zero for the slab_density calculation original value given at command line. */
49	tim	544	char * sele1_arg; /* select the first stuntdouble set. */
50	gezelter	929	char * sele1_orig; /* select the first stuntdouble set original value given at command line. */
51	tim	544	char * sele2_arg; /* select the second stuntdouble set. */
52	gezelter	929	char * sele2_orig; /* select the second stuntdouble set original value given at command line. */
53	tim	544	char * sele3_arg; /* select the third stuntdouble set. */
54	gezelter	929	char * sele3_orig; /* select the third stuntdouble set original value given at command line. */
55	tim	543	char * refsele_arg; /* select reference (use and only use with --gxyz). */
56	gezelter	929	char * refsele_orig; /* select reference (use and only use with --gxyz) original value given at command line. */
57	tim	544	char * molname_arg; /* molecule name. */
58	gezelter	929	char * molname_orig; /* molecule name original value given at command line. */
59	gezelter	1039	int begin_arg; /* begin internal index. */
60			char * begin_orig; /* begin internal index original value given at command line. */
61	tim	544	int end_arg; /* end internal index. */
62	gezelter	929	char * end_orig; /* end internal index original value given at command line. */
63
64	tim	543	int help_given ; /* Whether help was given. */
65			int version_given ; /* Whether version was given. */
66			int input_given ; /* Whether input was given. */
67			int output_given ; /* Whether output was given. */
68			int step_given ; /* Whether step was given. */
69			int nrbins_given ; /* Whether nrbins was given. */
70	xsun	967	int nbins_x_given ; /* Whether nbins_x was given. */
71			int nbins_y_given ; /* Whether nbins_y was given. */
72	tim	543	int nanglebins_given ; /* Whether nanglebins was given. */
73			int length_given ; /* Whether length was given. */
74	gezelter	1039	int LegendreL_given ; /* Whether LegendreL was given. */
75			int rcut_given ; /* Whether rcut was given. */
76	gezelter	929	int zoffset_given ; /* Whether zoffset was given. */
77	tim	543	int sele1_given ; /* Whether sele1 was given. */
78			int sele2_given ; /* Whether sele2 was given. */
79	tim	544	int sele3_given ; /* Whether sele3 was given. */
80	tim	543	int refsele_given ; /* Whether refsele was given. */
81	tim	544	int molname_given ; /* Whether molname was given. */
82			int begin_given ; /* Whether begin was given. */
83			int end_given ; /* Whether end was given. */
84	gezelter	1039	int bo_given ; /* Whether bo was given. */
85	tim	543	int gofr_given ; /* Whether gofr was given. */
86			int r_theta_given ; /* Whether r_theta was given. */
87			int r_omega_given ; /* Whether r_omega was given. */
88			int theta_omega_given ; /* Whether theta_omega was given. */
89			int gxyz_given ; /* Whether gxyz was given. */
90			int p2_given ; /* Whether p2 was given. */
91	xsun	980	int rp2_given ; /* Whether rp2 was given. */
92	tim	544	int scd_given ; /* Whether scd was given. */
93	tim	545	int density_given ; /* Whether density was given. */
94	tim	840	int slab_density_given ; /* Whether slab_density was given. */
95	xsun	967	int hxy_given ; /* Whether hxy was given. */
96	tim	310
97	gezelter	929	int staticProps_group_counter; /* counter for group staticProps */
98	tim	543	} ;
99	tim	310
100	tim	543	int cmdline_parser (int argc, char * const argv, struct gengetopt_args_info args_info);
101	gezelter	929	int cmdline_parser2 (int argc, char * const argv, struct gengetopt_args_info args_info, int override, int initialize, int check_required);
102			int cmdline_parser_file_save(const char filename, struct gengetopt_args_info args_info);
103	tim	310
104	tim	543	void cmdline_parser_print_help(void);
105			void cmdline_parser_print_version(void);
106	tim	310
107	gezelter	929	void cmdline_parser_init (struct gengetopt_args_info *args_info);
108			void cmdline_parser_free (struct gengetopt_args_info *args_info);
109
110			int cmdline_parser_required (struct gengetopt_args_info args_info, const char prog_name);
111
112
113	tim	310	#ifdef __cplusplus
114			}
115			#endif /* __cplusplus */
116			#endif /* STATICPROPSCMD_H */