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root/OpenMD/branches/development/src/applications/nanoparticleBuilder/nanoparticleBuilderCmd.h
Revision: 1069
Committed: Fri Oct 13 20:16:59 2006 UTC (19 years ago) by chuckv
Content type: text/plain
Original Path: trunk/src/applications/nanoparticleBuilder/nanoparticleBuilderCmd.h
File size: 3520 byte(s)
Log Message: 
Changed nanoparticle builder for new dump syntax.

File Contents

# User Rev Content
1 chuckv 653 /* nanoparticleBuilderCmd.h */
2    
3 chuckv 1069 /* File autogenerated by gengetopt version 2.15 */
4 chuckv 653
5     #ifndef NANOPARTICLEBUILDERCMD_H
6     #define NANOPARTICLEBUILDERCMD_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     #define CMDLINE_PARSER_PACKAGE "nanoparticleBuilder"
19     #endif
20    
21     #ifndef CMDLINE_PARSER_VERSION
22     #define CMDLINE_PARSER_VERSION "1.0"
23     #endif
24    
25     struct gengetopt_args_info
26     {
27     char * output_arg; /* Output file name. */
28 chuckv 1069 char * output_orig; /* Output file name original value given at command line. */
29 chuckv 653 double latticeCnst_arg; /* Lattice spacing in Angstroms for cubic lattice.. */
30 chuckv 1069 char * latticeCnst_orig; /* Lattice spacing in Angstroms for cubic lattice. original value given at command line. */
31 chuckv 653 double radius_arg; /* Nanoparticle radius in Angstroms. */
32 chuckv 1069 char * radius_orig; /* Nanoparticle radius in Angstroms original value given at command line. */
33 chuckv 653 double* ShellRadius_arg; /* Radius from the center of the particle to start a new shell in multi-component core-shell particle. Specified for each component > 1 in md file.. */
34 chuckv 1069 char ** ShellRadius_orig; /* Radius from the center of the particle to start a new shell in multi-component core-shell particle. Specified for each component > 1 in md file. original value given at command line. */
35 chuckv 653 double* molFraction_arg; /* (Default) Builds a multi-component random mixed nanoparticle. Mole Fraction must be specified for each componet > 1 in MD file.. */
36 chuckv 1069 char ** molFraction_orig; /* (Default) Builds a multi-component random mixed nanoparticle. Mole Fraction must be specified for each componet > 1 in MD file. original value given at command line. */
37 chuckv 653 double vacancyPCT_arg; /* Percentage of vacancies to build. */
38 chuckv 1069 char * vacancyPCT_orig; /* Percentage of vacancies to build original value given at command line. */
39 chuckv 653 double* vacancyRadius_arg; /* Radius arround core-shell where vacancies should be located.. */
40 chuckv 1069 char ** vacancyRadius_orig; /* Radius arround core-shell where vacancies should be located. original value given at command line. */
41 chuckv 653
42     int help_given ; /* Whether help was given. */
43     int version_given ; /* Whether version was given. */
44     int output_given ; /* Whether output was given. */
45     int latticeCnst_given ; /* Whether latticeCnst was given. */
46     int radius_given ; /* Whether radius was given. */
47     unsigned int ShellRadius_given ; /* Whether ShellRadius was given. */
48     unsigned int molFraction_given ; /* Whether molFraction was given. */
49     int vacancyPCT_given ; /* Whether vacancyPCT was given. */
50     unsigned int vacancyRadius_given ; /* Whether vacancyRadius was given. */
51    
52     char **inputs ; /* unamed options */
53     unsigned inputs_num ; /* unamed options number */
54     } ;
55    
56     int cmdline_parser (int argc, char * const *argv, struct gengetopt_args_info *args_info);
57     int cmdline_parser2 (int argc, char * const *argv, struct gengetopt_args_info *args_info, int override, int initialize, int check_required);
58 chuckv 1069 int cmdline_parser_file_save(const char *filename, struct gengetopt_args_info *args_info);
59 chuckv 653
60     void cmdline_parser_print_help(void);
61     void cmdline_parser_print_version(void);
62    
63     void cmdline_parser_init (struct gengetopt_args_info *args_info);
64     void cmdline_parser_free (struct gengetopt_args_info *args_info);
65    
66     int cmdline_parser_required (struct gengetopt_args_info *args_info, const char *prog_name);
67    
68    
69     #ifdef __cplusplus
70     }
71     #endif /* __cplusplus */
72     #endif /* NANOPARTICLEBUILDERCMD_H */