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root/OpenMD/trunk/src/applications/nanoparticleBuilder/nanoparticleBuilderCmd.h
Revision: 1390
Committed: Wed Nov 25 20:02:06 2009 UTC (15 years, 7 months ago) by gezelter
Content type: text/plain
File size: 10634 byte(s)
Log Message:
Almost all of the changes necessary to create OpenMD out of our old
project (OOPSE-4)

File Contents

# Content
1 /** @file nanoparticleBuilderCmd.h
2 * @brief The header file for the command line option parser
3 * generated by GNU Gengetopt version 2.22
4 * http://www.gnu.org/software/gengetopt.
5 * DO NOT modify this file, since it can be overwritten
6 * @author GNU Gengetopt by Lorenzo Bettini */
7
8 #ifndef NANOPARTICLEBUILDERCMD_H
9 #define NANOPARTICLEBUILDERCMD_H
10
11 /* If we use autoconf. */
12 #ifdef HAVE_CONFIG_H
13 #include "config.h"
14 #endif
15
16 #include <stdio.h> /* for FILE */
17
18 #ifdef __cplusplus
19 extern "C" {
20 #endif /* __cplusplus */
21
22 #ifndef CMDLINE_PARSER_PACKAGE
23 /** @brief the program name */
24 #define CMDLINE_PARSER_PACKAGE "nanoparticleBuilder"
25 #endif
26
27 #ifndef CMDLINE_PARSER_VERSION
28 /** @brief the program version */
29 #define CMDLINE_PARSER_VERSION "1.0"
30 #endif
31
32 /** @brief Where the command line options are stored */
33 struct gengetopt_args_info
34 {
35 const char *help_help; /**< @brief Print help and exit help description. */
36 const char *version_help; /**< @brief Print version and exit help description. */
37 char * output_arg; /**< @brief Output file name. */
38 char * output_orig; /**< @brief Output file name original value given at command line. */
39 const char *output_help; /**< @brief Output file name help description. */
40 double latticeConstant_arg; /**< @brief Lattice spacing in Angstroms for cubic lattice.. */
41 char * latticeConstant_orig; /**< @brief Lattice spacing in Angstroms for cubic lattice. original value given at command line. */
42 const char *latticeConstant_help; /**< @brief Lattice spacing in Angstroms for cubic lattice. help description. */
43 double radius_arg; /**< @brief Nanoparticle radius in Angstroms. */
44 char * radius_orig; /**< @brief Nanoparticle radius in Angstroms original value given at command line. */
45 const char *radius_help; /**< @brief Nanoparticle radius in Angstroms help description. */
46 double* shellRadius_arg; /**< @brief Radius containing within it only molecules of a specific component. Specified for each component > 1 in the template file.. */
47 char ** shellRadius_orig; /**< @brief Radius containing within it only molecules of a specific component. Specified for each component > 1 in the template file. original value given at command line. */
48 int shellRadius_min; /**< @brief Radius containing within it only molecules of a specific component. Specified for each component > 1 in the template file.'s minimum occurreces */
49 int shellRadius_max; /**< @brief Radius containing within it only molecules of a specific component. Specified for each component > 1 in the template file.'s maximum occurreces */
50 const char *shellRadius_help; /**< @brief Radius containing within it only molecules of a specific component. Specified for each component > 1 in the template file. help description. */
51 double* molFraction_arg; /**< @brief Builds a multi-component random alloy nanoparticle. A mole Fraction must be specified for each component > 1 in the template file.. */
52 char ** molFraction_orig; /**< @brief Builds a multi-component random alloy nanoparticle. A mole Fraction must be specified for each component > 1 in the template file. original value given at command line. */
53 int molFraction_min; /**< @brief Builds a multi-component random alloy nanoparticle. A mole Fraction must be specified for each component > 1 in the template file.'s minimum occurreces */
54 int molFraction_max; /**< @brief Builds a multi-component random alloy nanoparticle. A mole Fraction must be specified for each component > 1 in the template file.'s maximum occurreces */
55 const char *molFraction_help; /**< @brief Builds a multi-component random alloy nanoparticle. A mole Fraction must be specified for each component > 1 in the template file. help description. */
56 double vacancyPercent_arg; /**< @brief Percentage of atoms to remove from within vacancy range. */
57 char * vacancyPercent_orig; /**< @brief Percentage of atoms to remove from within vacancy range original value given at command line. */
58 const char *vacancyPercent_help; /**< @brief Percentage of atoms to remove from within vacancy range help description. */
59 double vacancyInnerRadius_arg; /**< @brief Radius arround core-shell where vacancies should be located.. */
60 char * vacancyInnerRadius_orig; /**< @brief Radius arround core-shell where vacancies should be located. original value given at command line. */
61 const char *vacancyInnerRadius_help; /**< @brief Radius arround core-shell where vacancies should be located. help description. */
62 double vacancyOuterRadius_arg; /**< @brief Radius arround core-shell where vacancies should be located.. */
63 char * vacancyOuterRadius_orig; /**< @brief Radius arround core-shell where vacancies should be located. original value given at command line. */
64 const char *vacancyOuterRadius_help; /**< @brief Radius arround core-shell where vacancies should be located. help description. */
65
66 unsigned int help_given ; /**< @brief Whether help was given. */
67 unsigned int version_given ; /**< @brief Whether version was given. */
68 unsigned int output_given ; /**< @brief Whether output was given. */
69 unsigned int latticeConstant_given ; /**< @brief Whether latticeConstant was given. */
70 unsigned int radius_given ; /**< @brief Whether radius was given. */
71 unsigned int shellRadius_given ; /**< @brief Whether shellRadius was given. */
72 unsigned int molFraction_given ; /**< @brief Whether molFraction was given. */
73 unsigned int vacancyPercent_given ; /**< @brief Whether vacancyPercent was given. */
74 unsigned int vacancyInnerRadius_given ; /**< @brief Whether vacancyInnerRadius was given. */
75 unsigned int vacancyOuterRadius_given ; /**< @brief Whether vacancyOuterRadius was given. */
76
77 char **inputs ; /**< @brief unamed options (options without names) */
78 unsigned inputs_num ; /**< @brief unamed options number */
79 } ;
80
81 /** @brief The additional parameters to pass to parser functions */
82 struct cmdline_parser_params
83 {
84 int override; /**< @brief whether to override possibly already present options (default 0) */
85 int initialize; /**< @brief whether to initialize the option structure gengetopt_args_info (default 1) */
86 int check_required; /**< @brief whether to check that all required options were provided (default 1) */
87 int check_ambiguity; /**< @brief whether to check for options already specified in the option structure gengetopt_args_info (default 0) */
88 int print_errors; /**< @brief whether getopt_long should print an error message for a bad option (default 1) */
89 } ;
90
91 /** @brief the purpose string of the program */
92 extern const char *gengetopt_args_info_purpose;
93 /** @brief the usage string of the program */
94 extern const char *gengetopt_args_info_usage;
95 /** @brief all the lines making the help output */
96 extern const char *gengetopt_args_info_help[];
97
98 /**
99 * The command line parser
100 * @param argc the number of command line options
101 * @param argv the command line options
102 * @param args_info the structure where option information will be stored
103 * @return 0 if everything went fine, NON 0 if an error took place
104 */
105 int cmdline_parser (int argc, char * const *argv,
106 struct gengetopt_args_info *args_info);
107
108 /**
109 * The command line parser (version with additional parameters - deprecated)
110 * @param argc the number of command line options
111 * @param argv the command line options
112 * @param args_info the structure where option information will be stored
113 * @param override whether to override possibly already present options
114 * @param initialize whether to initialize the option structure my_args_info
115 * @param check_required whether to check that all required options were provided
116 * @return 0 if everything went fine, NON 0 if an error took place
117 * @deprecated use cmdline_parser_ext() instead
118 */
119 int cmdline_parser2 (int argc, char * const *argv,
120 struct gengetopt_args_info *args_info,
121 int override, int initialize, int check_required);
122
123 /**
124 * The command line parser (version with additional parameters)
125 * @param argc the number of command line options
126 * @param argv the command line options
127 * @param args_info the structure where option information will be stored
128 * @param params additional parameters for the parser
129 * @return 0 if everything went fine, NON 0 if an error took place
130 */
131 int cmdline_parser_ext (int argc, char * const *argv,
132 struct gengetopt_args_info *args_info,
133 struct cmdline_parser_params *params);
134
135 /**
136 * Save the contents of the option struct into an already open FILE stream.
137 * @param outfile the stream where to dump options
138 * @param args_info the option struct to dump
139 * @return 0 if everything went fine, NON 0 if an error took place
140 */
141 int cmdline_parser_dump(FILE *outfile,
142 struct gengetopt_args_info *args_info);
143
144 /**
145 * Save the contents of the option struct into a (text) file.
146 * This file can be read by the config file parser (if generated by gengetopt)
147 * @param filename the file where to save
148 * @param args_info the option struct to save
149 * @return 0 if everything went fine, NON 0 if an error took place
150 */
151 int cmdline_parser_file_save(const char *filename,
152 struct gengetopt_args_info *args_info);
153
154 /**
155 * Print the help
156 */
157 void cmdline_parser_print_help(void);
158 /**
159 * Print the version
160 */
161 void cmdline_parser_print_version(void);
162
163 /**
164 * Initializes all the fields a cmdline_parser_params structure
165 * to their default values
166 * @param params the structure to initialize
167 */
168 void cmdline_parser_params_init(struct cmdline_parser_params *params);
169
170 /**
171 * Allocates dynamically a cmdline_parser_params structure and initializes
172 * all its fields to their default values
173 * @return the created and initialized cmdline_parser_params structure
174 */
175 struct cmdline_parser_params *cmdline_parser_params_create(void);
176
177 /**
178 * Initializes the passed gengetopt_args_info structure's fields
179 * (also set default values for options that have a default)
180 * @param args_info the structure to initialize
181 */
182 void cmdline_parser_init (struct gengetopt_args_info *args_info);
183 /**
184 * Deallocates the string fields of the gengetopt_args_info structure
185 * (but does not deallocate the structure itself)
186 * @param args_info the structure to deallocate
187 */
188 void cmdline_parser_free (struct gengetopt_args_info *args_info);
189
190 /**
191 * Checks that all the required options were specified
192 * @param args_info the structure to check
193 * @param prog_name the name of the program that will be used to print
194 * possible errors
195 * @return
196 */
197 int cmdline_parser_required (struct gengetopt_args_info *args_info,
198 const char *prog_name);
199
200
201 #ifdef __cplusplus
202 }
203 #endif /* __cplusplus */
204 #endif /* NANOPARTICLEBUILDERCMD_H */