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root/group/trunk/OOPSE/utils/Dump2XYZCmd.c
Revision: 1118
Committed: Mon Apr 19 03:52:27 2004 UTC (21 years ago) by tim
Content type: text/plain
File size: 10447 byte(s)
Log Message:
new implement of quickLate using visitor and composite pattern

File Contents

# Content
1 /*
2 File autogenerated by gengetopt version 2.11
3 generated with the following command:
4 /home/maul/gezelter/tim/program/gengetopt-2.11/src/gengetopt --file-name=Dump2XYZCmd
5
6 The developers of gengetopt consider the fixed text that goes in all
7 gengetopt output files to be in the public domain:
8 we make no copyright claims on it.
9 */
10
11
12 #include <stdio.h>
13 #include <stdlib.h>
14 #include <string.h>
15
16 /* If we use autoconf. */
17 #ifdef HAVE_CONFIG_H
18 #include "config.h"
19 #endif
20
21 #include "getopt.h"
22
23 #include "Dump2XYZCmd.h"
24
25 void
26 cmdline_parser_print_version (void)
27 {
28 printf ("%s %s\n", CMDLINE_PARSER_PACKAGE, CMDLINE_PARSER_VERSION);
29 }
30
31 void
32 cmdline_parser_print_help (void)
33 {
34 cmdline_parser_print_version ();
35 printf("\n"
36 "Usage: %s [OPTIONS]...\n", CMDLINE_PARSER_PACKAGE);
37 printf("\n");
38 printf(" -h, --help Print help and exit\n");
39 printf(" -V, --version Print version and exit\n");
40 printf(" -i, --input=filename input dump file\n");
41 printf(" -o, --output=STRING output file name\n");
42 printf(" -n, --frame=INT print every n frame (default=`1')\n");
43 printf(" -d, --dipole print the dipole moments (default=off)\n");
44 printf(" -w, --water skip the the waters (default=off)\n");
45 printf(" -m, --periodicBox map to the periodic box (default=off)\n");
46 printf(" -r, --replace replace the atom types of zconstraint molecules \n (default=off)\n");
47 printf(" -s, --ignore=atomtype ignore the atom types\n");
48 printf(" --repeatX=INT The number of images to repeat in the x direction \n (default=`0')\n");
49 printf(" --repeatY=INT The number of images to repeat in the y direction \n (default=`0')\n");
50 printf(" --repeatZ=INT The number of images to repeat in the z direction \n (default=`0')\n");
51 }
52
53
54 static char *gengetopt_strdup (const char *s);
55
56 /* gengetopt_strdup() */
57 /* strdup.c replacement of strdup, which is not standard */
58 char *
59 gengetopt_strdup (const char *s)
60 {
61 char *result = (char*)malloc(strlen(s) + 1);
62 if (result == (char*)0)
63 return (char*)0;
64 strcpy(result, s);
65 return result;
66 }
67
68 int
69 cmdline_parser (int argc, char * const *argv, struct gengetopt_args_info *args_info)
70 {
71 int c; /* Character of the parsed option. */
72 int i; /* Counter */
73 struct ignore_list
74 {
75 char * ignore_arg;
76 struct ignore_list * next;
77 };
78 struct ignore_list * ignore_list = NULL,* ignore_new = NULL;
79
80 int missing_required_options = 0;
81
82 args_info->help_given = 0 ;
83 args_info->version_given = 0 ;
84 args_info->input_given = 0 ;
85 args_info->output_given = 0 ;
86 args_info->frame_given = 0 ;
87 args_info->dipole_given = 0 ;
88 args_info->water_given = 0 ;
89 args_info->periodicBox_given = 0 ;
90 args_info->replace_given = 0 ;
91 args_info->ignore_given = 0 ;
92 args_info->repeatX_given = 0 ;
93 args_info->repeatY_given = 0 ;
94 args_info->repeatZ_given = 0 ;
95 #define clear_args() { \
96 args_info->input_arg = NULL; \
97 args_info->output_arg = NULL; \
98 args_info->frame_arg = 1 ;\
99 args_info->dipole_flag = 0;\
100 args_info->water_flag = 0;\
101 args_info->periodicBox_flag = 0;\
102 args_info->replace_flag = 0;\
103 args_info->ignore_arg = NULL; \
104 args_info->repeatX_arg = 0 ;\
105 args_info->repeatY_arg = 0 ;\
106 args_info->repeatZ_arg = 0 ;\
107 }
108
109 clear_args();
110
111 optarg = 0;
112 optind = 1;
113 opterr = 1;
114 optopt = '?';
115
116 while (1)
117 {
118 int option_index = 0;
119 char *stop_char;
120
121 static struct option long_options[] = {
122 { "help", 0, NULL, 'h' },
123 { "version", 0, NULL, 'V' },
124 { "input", 1, NULL, 'i' },
125 { "output", 1, NULL, 'o' },
126 { "frame", 1, NULL, 'n' },
127 { "dipole", 0, NULL, 'd' },
128 { "water", 0, NULL, 'w' },
129 { "periodicBox", 0, NULL, 'm' },
130 { "replace", 0, NULL, 'r' },
131 { "ignore", 1, NULL, 's' },
132 { "repeatX", 1, NULL, 0 },
133 { "repeatY", 1, NULL, 0 },
134 { "repeatZ", 1, NULL, 0 },
135 { NULL, 0, NULL, 0 }
136 };
137
138 stop_char = 0;
139 c = getopt_long (argc, argv, "hVi:o:n:dwmrs:", long_options, &option_index);
140
141 if (c == -1) break; /* Exit from `while (1)' loop. */
142
143 switch (c)
144 {
145 case 'h': /* Print help and exit. */
146 clear_args ();
147 cmdline_parser_print_help ();
148 exit (EXIT_SUCCESS);
149
150 case 'V': /* Print version and exit. */
151 clear_args ();
152 cmdline_parser_print_version ();
153 exit (EXIT_SUCCESS);
154
155 case 'i': /* input dump file. */
156 if (args_info->input_given)
157 {
158 fprintf (stderr, "%s: `--input' (`-i') option given more than once\n", CMDLINE_PARSER_PACKAGE);
159 clear_args ();
160 exit (EXIT_FAILURE);
161 }
162 args_info->input_given = 1;
163 args_info->input_arg = gengetopt_strdup (optarg);
164 break;
165
166 case 'o': /* output file name. */
167 if (args_info->output_given)
168 {
169 fprintf (stderr, "%s: `--output' (`-o') option given more than once\n", CMDLINE_PARSER_PACKAGE);
170 clear_args ();
171 exit (EXIT_FAILURE);
172 }
173 args_info->output_given = 1;
174 args_info->output_arg = gengetopt_strdup (optarg);
175 break;
176
177 case 'n': /* print every n frame. */
178 if (args_info->frame_given)
179 {
180 fprintf (stderr, "%s: `--frame' (`-n') option given more than once\n", CMDLINE_PARSER_PACKAGE);
181 clear_args ();
182 exit (EXIT_FAILURE);
183 }
184 args_info->frame_given = 1;
185 args_info->frame_arg = strtol (optarg,&stop_char,0);
186 break;
187
188 case 'd': /* print the dipole moments. */
189 if (args_info->dipole_given)
190 {
191 fprintf (stderr, "%s: `--dipole' (`-d') option given more than once\n", CMDLINE_PARSER_PACKAGE);
192 clear_args ();
193 exit (EXIT_FAILURE);
194 }
195 args_info->dipole_given = 1;
196 args_info->dipole_flag = !(args_info->dipole_flag);
197 break;
198
199 case 'w': /* skip the the waters. */
200 if (args_info->water_given)
201 {
202 fprintf (stderr, "%s: `--water' (`-w') option given more than once\n", CMDLINE_PARSER_PACKAGE);
203 clear_args ();
204 exit (EXIT_FAILURE);
205 }
206 args_info->water_given = 1;
207 args_info->water_flag = !(args_info->water_flag);
208 break;
209
210 case 'm': /* map to the periodic box. */
211 if (args_info->periodicBox_given)
212 {
213 fprintf (stderr, "%s: `--periodicBox' (`-m') option given more than once\n", CMDLINE_PARSER_PACKAGE);
214 clear_args ();
215 exit (EXIT_FAILURE);
216 }
217 args_info->periodicBox_given = 1;
218 args_info->periodicBox_flag = !(args_info->periodicBox_flag);
219 break;
220
221 case 'r': /* replace the atom types of zconstraint molecules. */
222 if (args_info->replace_given)
223 {
224 fprintf (stderr, "%s: `--replace' (`-r') option given more than once\n", CMDLINE_PARSER_PACKAGE);
225 clear_args ();
226 exit (EXIT_FAILURE);
227 }
228 args_info->replace_given = 1;
229 args_info->replace_flag = !(args_info->replace_flag);
230 break;
231
232 case 's': /* ignore the atom types. */
233 args_info->ignore_given++;
234 ignore_new = (struct ignore_list *) malloc (sizeof (struct ignore_list));
235 ignore_new->next = ignore_list;
236 ignore_list = ignore_new;
237 ignore_new->ignore_arg = gengetopt_strdup (optarg);
238 break;
239
240
241 case 0: /* Long option with no short option */
242 /* The number of images to repeat in the x direction. */
243 if (strcmp (long_options[option_index].name, "repeatX") == 0)
244 {
245 if (args_info->repeatX_given)
246 {
247 fprintf (stderr, "%s: `--repeatX' option given more than once\n", CMDLINE_PARSER_PACKAGE);
248 clear_args ();
249 exit (EXIT_FAILURE);
250 }
251 args_info->repeatX_given = 1;
252 args_info->repeatX_arg = strtol (optarg,&stop_char,0);
253 break;
254 }
255
256 /* The number of images to repeat in the y direction. */
257 else if (strcmp (long_options[option_index].name, "repeatY") == 0)
258 {
259 if (args_info->repeatY_given)
260 {
261 fprintf (stderr, "%s: `--repeatY' option given more than once\n", CMDLINE_PARSER_PACKAGE);
262 clear_args ();
263 exit (EXIT_FAILURE);
264 }
265 args_info->repeatY_given = 1;
266 args_info->repeatY_arg = strtol (optarg,&stop_char,0);
267 break;
268 }
269
270 /* The number of images to repeat in the z direction. */
271 else if (strcmp (long_options[option_index].name, "repeatZ") == 0)
272 {
273 if (args_info->repeatZ_given)
274 {
275 fprintf (stderr, "%s: `--repeatZ' option given more than once\n", CMDLINE_PARSER_PACKAGE);
276 clear_args ();
277 exit (EXIT_FAILURE);
278 }
279 args_info->repeatZ_given = 1;
280 args_info->repeatZ_arg = strtol (optarg,&stop_char,0);
281 break;
282 }
283
284
285 case '?': /* Invalid option. */
286 /* `getopt_long' already printed an error message. */
287 exit (EXIT_FAILURE);
288
289 default: /* bug: option not considered. */
290 fprintf (stderr, "%s: option unknown: %c\n", CMDLINE_PARSER_PACKAGE, c);
291 abort ();
292 } /* switch */
293 } /* while */
294
295
296 if (! args_info->input_given)
297 {
298 fprintf (stderr, "%s: '--input' ('-i') option required\n", CMDLINE_PARSER_PACKAGE);
299 missing_required_options = 1;
300 }
301 if ( missing_required_options )
302 exit (EXIT_FAILURE);
303
304 if (args_info->ignore_given)
305 {
306 args_info->ignore_arg = (char * *) malloc (args_info->ignore_given * sizeof (char *));
307 for (i = 0; i < args_info->ignore_given; i++)
308 {
309 args_info->ignore_arg [i] = ignore_list->ignore_arg;
310 ignore_list = ignore_list->next;
311 }
312 }
313
314 return 0;
315 }