ViewVC Help
View File | Revision Log | Show Annotations | View Changeset | Root Listing
root/group/trunk/OOPSE-4/src/applications/dump2Xyz/Dump2XYZCmd.c
Revision: 2099
Committed: Wed Mar 9 18:46:16 2005 UTC (19 years, 4 months ago) by tim
Content type: text/plain
File size: 12443 byte(s)
Log Message:
fix compilation issue

File Contents

# User Rev Content
1 tim 1501 /*
2     File autogenerated by gengetopt version 2.11
3     generated with the following command:
4 tim 1986 /home/maul/gezelter/tim/bin/gengetopt -F Dump2XYZCmd
5 tim 1501
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 tim 1975 #include "Dump2XYZCmd.h"
24 tim 1501
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 tim 2053 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=filename output file name\n");
42     printf(" -n, --frame=INT print every n frame (default=`1')\n");
43     printf(" -w, --water skip the the waters (default=off)\n");
44     printf(" -m, --periodicBox map to the periodic box (default=off)\n");
45     printf(" -z, --zconstraint replace the atom types of zconstraint \n molecules (default=off)\n");
46     printf(" -r, --rigidbody add a pseudo COM atom to rigidbody \n (default=off)\n");
47     printf(" -t, --watertype replace the atom type of water model \n (default=on)\n");
48 tim 2099 printf(" -s, --selection=selection script general selection syntax\n");
49 tim 2053 printf(" --originsele=selection script select origin\n");
50     printf(" --refsele=selection script select reference\n");
51     printf(" --repeatX=INT The number of images to repeat in the x \n direction (default=`0')\n");
52     printf(" --repeatY=INT The number of images to repeat in the y \n direction (default=`0')\n");
53     printf(" --repeatZ=INT The number of images to repeat in the z \n direction (default=`0')\n");
54 tim 1501 }
55    
56    
57     static char *gengetopt_strdup (const char *s);
58    
59     /* gengetopt_strdup() */
60     /* strdup.c replacement of strdup, which is not standard */
61     char *
62     gengetopt_strdup (const char *s)
63     {
64     char *result = (char*)malloc(strlen(s) + 1);
65     if (result == (char*)0)
66     return (char*)0;
67     strcpy(result, s);
68     return result;
69     }
70    
71     int
72     cmdline_parser (int argc, char * const *argv, struct gengetopt_args_info *args_info)
73     {
74     int c; /* Character of the parsed option. */
75     int missing_required_options = 0;
76    
77     args_info->help_given = 0 ;
78     args_info->version_given = 0 ;
79     args_info->input_given = 0 ;
80     args_info->output_given = 0 ;
81     args_info->frame_given = 0 ;
82     args_info->water_given = 0 ;
83     args_info->periodicBox_given = 0 ;
84     args_info->zconstraint_given = 0 ;
85     args_info->rigidbody_given = 0 ;
86     args_info->watertype_given = 0 ;
87 tim 1975 args_info->selection_given = 0 ;
88 tim 2053 args_info->originsele_given = 0 ;
89     args_info->refsele_given = 0 ;
90 tim 1501 args_info->repeatX_given = 0 ;
91     args_info->repeatY_given = 0 ;
92     args_info->repeatZ_given = 0 ;
93     #define clear_args() { \
94     args_info->input_arg = NULL; \
95     args_info->output_arg = NULL; \
96     args_info->frame_arg = 1 ;\
97     args_info->water_flag = 0;\
98     args_info->periodicBox_flag = 0;\
99     args_info->zconstraint_flag = 0;\
100     args_info->rigidbody_flag = 0;\
101     args_info->watertype_flag = 1;\
102 tim 1975 args_info->selection_arg = NULL; \
103 tim 2053 args_info->originsele_arg = NULL; \
104     args_info->refsele_arg = NULL; \
105 tim 1501 args_info->repeatX_arg = 0 ;\
106     args_info->repeatY_arg = 0 ;\
107     args_info->repeatZ_arg = 0 ;\
108     }
109    
110     clear_args();
111    
112     optarg = 0;
113     optind = 1;
114     opterr = 1;
115     optopt = '?';
116    
117     while (1)
118     {
119     int option_index = 0;
120     char *stop_char;
121    
122     static struct option long_options[] = {
123     { "help", 0, NULL, 'h' },
124     { "version", 0, NULL, 'V' },
125     { "input", 1, NULL, 'i' },
126     { "output", 1, NULL, 'o' },
127     { "frame", 1, NULL, 'n' },
128     { "water", 0, NULL, 'w' },
129     { "periodicBox", 0, NULL, 'm' },
130     { "zconstraint", 0, NULL, 'z' },
131     { "rigidbody", 0, NULL, 'r' },
132     { "watertype", 0, NULL, 't' },
133 tim 1975 { "selection", 1, NULL, 's' },
134 tim 2053 { "originsele", 1, NULL, 0 },
135     { "refsele", 1, NULL, 0 },
136 tim 1501 { "repeatX", 1, NULL, 0 },
137     { "repeatY", 1, NULL, 0 },
138     { "repeatZ", 1, NULL, 0 },
139     { NULL, 0, NULL, 0 }
140     };
141    
142     stop_char = 0;
143 tim 2097 c = getopt_long (argc, argv, "hVi:o:n:wmzrts:", long_options, &option_index);
144 tim 1501
145     if (c == -1) break; /* Exit from `while (1)' loop. */
146    
147     switch (c)
148     {
149     case 'h': /* Print help and exit. */
150     clear_args ();
151     cmdline_parser_print_help ();
152     exit (EXIT_SUCCESS);
153    
154     case 'V': /* Print version and exit. */
155     clear_args ();
156     cmdline_parser_print_version ();
157     exit (EXIT_SUCCESS);
158    
159     case 'i': /* input dump file. */
160     if (args_info->input_given)
161     {
162     fprintf (stderr, "%s: `--input' (`-i') option given more than once\n", CMDLINE_PARSER_PACKAGE);
163     clear_args ();
164     exit (EXIT_FAILURE);
165     }
166     args_info->input_given = 1;
167     args_info->input_arg = gengetopt_strdup (optarg);
168     break;
169    
170     case 'o': /* output file name. */
171     if (args_info->output_given)
172     {
173     fprintf (stderr, "%s: `--output' (`-o') option given more than once\n", CMDLINE_PARSER_PACKAGE);
174     clear_args ();
175     exit (EXIT_FAILURE);
176     }
177     args_info->output_given = 1;
178     args_info->output_arg = gengetopt_strdup (optarg);
179     break;
180    
181     case 'n': /* print every n frame. */
182     if (args_info->frame_given)
183     {
184     fprintf (stderr, "%s: `--frame' (`-n') option given more than once\n", CMDLINE_PARSER_PACKAGE);
185     clear_args ();
186     exit (EXIT_FAILURE);
187     }
188     args_info->frame_given = 1;
189     args_info->frame_arg = strtol (optarg,&stop_char,0);
190     break;
191    
192     case 'w': /* skip the the waters. */
193     if (args_info->water_given)
194     {
195     fprintf (stderr, "%s: `--water' (`-w') option given more than once\n", CMDLINE_PARSER_PACKAGE);
196     clear_args ();
197     exit (EXIT_FAILURE);
198     }
199     args_info->water_given = 1;
200     args_info->water_flag = !(args_info->water_flag);
201     break;
202    
203     case 'm': /* map to the periodic box. */
204     if (args_info->periodicBox_given)
205     {
206     fprintf (stderr, "%s: `--periodicBox' (`-m') option given more than once\n", CMDLINE_PARSER_PACKAGE);
207     clear_args ();
208     exit (EXIT_FAILURE);
209     }
210     args_info->periodicBox_given = 1;
211     args_info->periodicBox_flag = !(args_info->periodicBox_flag);
212     break;
213    
214     case 'z': /* replace the atom types of zconstraint molecules. */
215     if (args_info->zconstraint_given)
216     {
217     fprintf (stderr, "%s: `--zconstraint' (`-z') option given more than once\n", CMDLINE_PARSER_PACKAGE);
218     clear_args ();
219     exit (EXIT_FAILURE);
220     }
221     args_info->zconstraint_given = 1;
222     args_info->zconstraint_flag = !(args_info->zconstraint_flag);
223     break;
224    
225     case 'r': /* add a pseudo COM atom to rigidbody. */
226     if (args_info->rigidbody_given)
227     {
228     fprintf (stderr, "%s: `--rigidbody' (`-r') option given more than once\n", CMDLINE_PARSER_PACKAGE);
229     clear_args ();
230     exit (EXIT_FAILURE);
231     }
232     args_info->rigidbody_given = 1;
233     args_info->rigidbody_flag = !(args_info->rigidbody_flag);
234     break;
235    
236     case 't': /* replace the atom type of water model. */
237     if (args_info->watertype_given)
238     {
239     fprintf (stderr, "%s: `--watertype' (`-t') option given more than once\n", CMDLINE_PARSER_PACKAGE);
240     clear_args ();
241     exit (EXIT_FAILURE);
242     }
243     args_info->watertype_given = 1;
244     args_info->watertype_flag = !(args_info->watertype_flag);
245     break;
246    
247 tim 2099 case 's': /* general selection syntax. */
248 tim 1975 if (args_info->selection_given)
249     {
250     fprintf (stderr, "%s: `--selection' (`-s') option given more than once\n", CMDLINE_PARSER_PACKAGE);
251     clear_args ();
252     exit (EXIT_FAILURE);
253     }
254     args_info->selection_given = 1;
255     args_info->selection_arg = gengetopt_strdup (optarg);
256     break;
257 tim 1501
258 tim 1975
259 tim 1501 case 0: /* Long option with no short option */
260 tim 2053 /* select origin. */
261     if (strcmp (long_options[option_index].name, "originsele") == 0)
262     {
263     if (args_info->originsele_given)
264     {
265     fprintf (stderr, "%s: `--originsele' option given more than once\n", CMDLINE_PARSER_PACKAGE);
266     clear_args ();
267     exit (EXIT_FAILURE);
268     }
269     args_info->originsele_given = 1;
270     args_info->originsele_arg = gengetopt_strdup (optarg);
271     break;
272     }
273    
274     /* select reference. */
275     else if (strcmp (long_options[option_index].name, "refsele") == 0)
276     {
277     if (args_info->refsele_given)
278     {
279     fprintf (stderr, "%s: `--refsele' option given more than once\n", CMDLINE_PARSER_PACKAGE);
280     clear_args ();
281     exit (EXIT_FAILURE);
282     }
283     args_info->refsele_given = 1;
284     args_info->refsele_arg = gengetopt_strdup (optarg);
285     break;
286     }
287    
288 tim 1501 /* The number of images to repeat in the x direction. */
289 tim 2053 else if (strcmp (long_options[option_index].name, "repeatX") == 0)
290 tim 1501 {
291     if (args_info->repeatX_given)
292     {
293     fprintf (stderr, "%s: `--repeatX' option given more than once\n", CMDLINE_PARSER_PACKAGE);
294     clear_args ();
295     exit (EXIT_FAILURE);
296     }
297     args_info->repeatX_given = 1;
298     args_info->repeatX_arg = strtol (optarg,&stop_char,0);
299     break;
300     }
301    
302     /* The number of images to repeat in the y direction. */
303     else if (strcmp (long_options[option_index].name, "repeatY") == 0)
304     {
305     if (args_info->repeatY_given)
306     {
307     fprintf (stderr, "%s: `--repeatY' option given more than once\n", CMDLINE_PARSER_PACKAGE);
308     clear_args ();
309     exit (EXIT_FAILURE);
310     }
311     args_info->repeatY_given = 1;
312     args_info->repeatY_arg = strtol (optarg,&stop_char,0);
313     break;
314     }
315    
316     /* The number of images to repeat in the z direction. */
317     else if (strcmp (long_options[option_index].name, "repeatZ") == 0)
318     {
319     if (args_info->repeatZ_given)
320     {
321     fprintf (stderr, "%s: `--repeatZ' option given more than once\n", CMDLINE_PARSER_PACKAGE);
322     clear_args ();
323     exit (EXIT_FAILURE);
324     }
325     args_info->repeatZ_given = 1;
326     args_info->repeatZ_arg = strtol (optarg,&stop_char,0);
327     break;
328     }
329    
330    
331     case '?': /* Invalid option. */
332     /* `getopt_long' already printed an error message. */
333     exit (EXIT_FAILURE);
334    
335     default: /* bug: option not considered. */
336     fprintf (stderr, "%s: option unknown: %c\n", CMDLINE_PARSER_PACKAGE, c);
337     abort ();
338     } /* switch */
339     } /* while */
340    
341    
342     if (! args_info->input_given)
343     {
344     fprintf (stderr, "%s: '--input' ('-i') option required\n", CMDLINE_PARSER_PACKAGE);
345     missing_required_options = 1;
346     }
347     if ( missing_required_options )
348     exit (EXIT_FAILURE);
349    
350     return 0;
351     }