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root/OpenMD/trunk/src/applications/dynamicProps/DynamicPropsCmd.cpp
Revision: 1939
Committed: Thu Oct 31 18:18:57 2013 UTC (11 years, 6 months ago) by gezelter
File size: 33786 byte(s)
Log Message:
Some fixes for MSVC compilation

File Contents

# Content
1 /*
2 File autogenerated by gengetopt version 2.22.4
3 generated with the following command:
4 gengetopt --file-name=DynamicPropsCmd --unamed-opts
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 /* If we use autoconf. */
12 #ifdef HAVE_CONFIG_H
13 #include "config.h"
14 #endif
15
16 #include <stdio.h>
17 #include <stdlib.h>
18 #include <string.h>
19
20 #ifndef FIX_UNUSED
21 #define FIX_UNUSED(X) (void) (X) /* avoid warnings for unused params */
22 #endif
23
24 #ifdef WIN32
25 #include "utils/wingetopt.h"
26 #else
27 #include <getopt.h>
28 #endif
29
30 #include "DynamicPropsCmd.h"
31
32 const char *gengetopt_args_info_purpose = "";
33
34 const char *gengetopt_args_info_usage = "Usage: DynamicProps [OPTIONS]... [FILES]...";
35
36 const char *gengetopt_args_info_description = "";
37
38 const char *gengetopt_args_info_help[] = {
39 " -h, --help Print help and exit",
40 " -V, --version Print version and exit",
41 " -i, --input=filename input dump file",
42 " -o, --output=filename output file name",
43 " --sele1=selection script select first stuntdouble set",
44 " --sele2=selection script select second stuntdouble set (if sele2 is not \n set, use script from sele1)",
45 " --order=INT Lengendre Polynomial Order",
46 " -z, --nzbins=INT Number of Z bins (default=`100')",
47 " -m, --memory=memory specification\n Available memory (defaults to 2G) \n (default=`2G')",
48 "\n Group: dynamicProps\n an option of this group is required",
49 " -s, --selecorr selection correlation function",
50 " -r, --rcorr rmsd",
51 " -v, --vcorr velocity correlation function",
52 " -d, --dcorr dipole correlation function",
53 " -l, --lcorr Lengendre correlation function",
54 " --lcorrZ Lengendre correlation function binned by Z",
55 " --cohZ Lengendre correlation function for OH bond \n vectors binned by Z",
56 " -M, --sdcorr System dipole correlation function",
57 " --r_rcorr Radial rmsd",
58 " --thetacorr Angular rmsd",
59 " --drcorr Directional rmsd for particles with unit \n vectors",
60 " --helfandEcorr Helfand moment for thermal conductvity",
61 " -p, --momentum Helfand momentum for viscosity",
62 " --stresscorr Stress tensor correlation function",
63 0
64 };
65
66 typedef enum {ARG_NO
67 , ARG_STRING
68 , ARG_INT
69 } cmdline_parser_arg_type;
70
71 static
72 void clear_given (struct gengetopt_args_info *args_info);
73 static
74 void clear_args (struct gengetopt_args_info *args_info);
75
76 static int
77 cmdline_parser_internal (int argc, char **argv, struct gengetopt_args_info *args_info,
78 struct cmdline_parser_params *params, const char *additional_error);
79
80 static int
81 cmdline_parser_required2 (struct gengetopt_args_info *args_info, const char *prog_name, const char *additional_error);
82
83 static char *
84 gengetopt_strdup (const char *s);
85
86 static
87 void clear_given (struct gengetopt_args_info *args_info)
88 {
89 args_info->help_given = 0 ;
90 args_info->version_given = 0 ;
91 args_info->input_given = 0 ;
92 args_info->output_given = 0 ;
93 args_info->sele1_given = 0 ;
94 args_info->sele2_given = 0 ;
95 args_info->order_given = 0 ;
96 args_info->nzbins_given = 0 ;
97 args_info->memory_given = 0 ;
98 args_info->selecorr_given = 0 ;
99 args_info->rcorr_given = 0 ;
100 args_info->vcorr_given = 0 ;
101 args_info->dcorr_given = 0 ;
102 args_info->lcorr_given = 0 ;
103 args_info->lcorrZ_given = 0 ;
104 args_info->cohZ_given = 0 ;
105 args_info->sdcorr_given = 0 ;
106 args_info->r_rcorr_given = 0 ;
107 args_info->thetacorr_given = 0 ;
108 args_info->drcorr_given = 0 ;
109 args_info->helfandEcorr_given = 0 ;
110 args_info->momentum_given = 0 ;
111 args_info->stresscorr_given = 0 ;
112 args_info->dynamicProps_group_counter = 0 ;
113 }
114
115 static
116 void clear_args (struct gengetopt_args_info *args_info)
117 {
118 FIX_UNUSED (args_info);
119 args_info->input_arg = NULL;
120 args_info->input_orig = NULL;
121 args_info->output_arg = NULL;
122 args_info->output_orig = NULL;
123 args_info->sele1_arg = NULL;
124 args_info->sele1_orig = NULL;
125 args_info->sele2_arg = NULL;
126 args_info->sele2_orig = NULL;
127 args_info->order_orig = NULL;
128 args_info->nzbins_arg = 100;
129 args_info->nzbins_orig = NULL;
130 args_info->memory_arg = gengetopt_strdup ("2G");
131 args_info->memory_orig = NULL;
132
133 }
134
135 static
136 void init_args_info(struct gengetopt_args_info *args_info)
137 {
138
139
140 args_info->help_help = gengetopt_args_info_help[0] ;
141 args_info->version_help = gengetopt_args_info_help[1] ;
142 args_info->input_help = gengetopt_args_info_help[2] ;
143 args_info->output_help = gengetopt_args_info_help[3] ;
144 args_info->sele1_help = gengetopt_args_info_help[4] ;
145 args_info->sele2_help = gengetopt_args_info_help[5] ;
146 args_info->order_help = gengetopt_args_info_help[6] ;
147 args_info->nzbins_help = gengetopt_args_info_help[7] ;
148 args_info->memory_help = gengetopt_args_info_help[8] ;
149 args_info->selecorr_help = gengetopt_args_info_help[10] ;
150 args_info->rcorr_help = gengetopt_args_info_help[11] ;
151 args_info->vcorr_help = gengetopt_args_info_help[12] ;
152 args_info->dcorr_help = gengetopt_args_info_help[13] ;
153 args_info->lcorr_help = gengetopt_args_info_help[14] ;
154 args_info->lcorrZ_help = gengetopt_args_info_help[15] ;
155 args_info->cohZ_help = gengetopt_args_info_help[16] ;
156 args_info->sdcorr_help = gengetopt_args_info_help[17] ;
157 args_info->r_rcorr_help = gengetopt_args_info_help[18] ;
158 args_info->thetacorr_help = gengetopt_args_info_help[19] ;
159 args_info->drcorr_help = gengetopt_args_info_help[20] ;
160 args_info->helfandEcorr_help = gengetopt_args_info_help[21] ;
161 args_info->momentum_help = gengetopt_args_info_help[22] ;
162 args_info->stresscorr_help = gengetopt_args_info_help[23] ;
163
164 }
165
166 void
167 cmdline_parser_print_version (void)
168 {
169 printf ("%s %s\n",
170 (strlen(CMDLINE_PARSER_PACKAGE_NAME) ? CMDLINE_PARSER_PACKAGE_NAME : CMDLINE_PARSER_PACKAGE),
171 CMDLINE_PARSER_VERSION);
172 }
173
174 static void print_help_common(void) {
175 cmdline_parser_print_version ();
176
177 if (strlen(gengetopt_args_info_purpose) > 0)
178 printf("\n%s\n", gengetopt_args_info_purpose);
179
180 if (strlen(gengetopt_args_info_usage) > 0)
181 printf("\n%s\n", gengetopt_args_info_usage);
182
183 printf("\n");
184
185 if (strlen(gengetopt_args_info_description) > 0)
186 printf("%s\n\n", gengetopt_args_info_description);
187 }
188
189 void
190 cmdline_parser_print_help (void)
191 {
192 int i = 0;
193 print_help_common();
194 while (gengetopt_args_info_help[i])
195 printf("%s\n", gengetopt_args_info_help[i++]);
196 }
197
198 void
199 cmdline_parser_init (struct gengetopt_args_info *args_info)
200 {
201 clear_given (args_info);
202 clear_args (args_info);
203 init_args_info (args_info);
204
205 args_info->inputs = 0;
206 args_info->inputs_num = 0;
207 }
208
209 void
210 cmdline_parser_params_init(struct cmdline_parser_params *params)
211 {
212 if (params)
213 {
214 params->override = 0;
215 params->initialize = 1;
216 params->check_required = 1;
217 params->check_ambiguity = 0;
218 params->print_errors = 1;
219 }
220 }
221
222 struct cmdline_parser_params *
223 cmdline_parser_params_create(void)
224 {
225 struct cmdline_parser_params *params =
226 (struct cmdline_parser_params *)malloc(sizeof(struct cmdline_parser_params));
227 cmdline_parser_params_init(params);
228 return params;
229 }
230
231 static void
232 free_string_field (char **s)
233 {
234 if (*s)
235 {
236 free (*s);
237 *s = 0;
238 }
239 }
240
241
242 static void
243 cmdline_parser_release (struct gengetopt_args_info *args_info)
244 {
245 unsigned int i;
246 free_string_field (&(args_info->input_arg));
247 free_string_field (&(args_info->input_orig));
248 free_string_field (&(args_info->output_arg));
249 free_string_field (&(args_info->output_orig));
250 free_string_field (&(args_info->sele1_arg));
251 free_string_field (&(args_info->sele1_orig));
252 free_string_field (&(args_info->sele2_arg));
253 free_string_field (&(args_info->sele2_orig));
254 free_string_field (&(args_info->order_orig));
255 free_string_field (&(args_info->nzbins_orig));
256 free_string_field (&(args_info->memory_arg));
257 free_string_field (&(args_info->memory_orig));
258
259
260 for (i = 0; i < args_info->inputs_num; ++i)
261 free (args_info->inputs [i]);
262
263 if (args_info->inputs_num)
264 free (args_info->inputs);
265
266 clear_given (args_info);
267 }
268
269
270 static void
271 write_into_file(FILE *outfile, const char *opt, const char *arg, const char *values[])
272 {
273 FIX_UNUSED (values);
274 if (arg) {
275 fprintf(outfile, "%s=\"%s\"\n", opt, arg);
276 } else {
277 fprintf(outfile, "%s\n", opt);
278 }
279 }
280
281
282 int
283 cmdline_parser_dump(FILE *outfile, struct gengetopt_args_info *args_info)
284 {
285 int i = 0;
286
287 if (!outfile)
288 {
289 fprintf (stderr, "%s: cannot dump options to stream\n", CMDLINE_PARSER_PACKAGE);
290 return EXIT_FAILURE;
291 }
292
293 if (args_info->help_given)
294 write_into_file(outfile, "help", 0, 0 );
295 if (args_info->version_given)
296 write_into_file(outfile, "version", 0, 0 );
297 if (args_info->input_given)
298 write_into_file(outfile, "input", args_info->input_orig, 0);
299 if (args_info->output_given)
300 write_into_file(outfile, "output", args_info->output_orig, 0);
301 if (args_info->sele1_given)
302 write_into_file(outfile, "sele1", args_info->sele1_orig, 0);
303 if (args_info->sele2_given)
304 write_into_file(outfile, "sele2", args_info->sele2_orig, 0);
305 if (args_info->order_given)
306 write_into_file(outfile, "order", args_info->order_orig, 0);
307 if (args_info->nzbins_given)
308 write_into_file(outfile, "nzbins", args_info->nzbins_orig, 0);
309 if (args_info->memory_given)
310 write_into_file(outfile, "memory", args_info->memory_orig, 0);
311 if (args_info->selecorr_given)
312 write_into_file(outfile, "selecorr", 0, 0 );
313 if (args_info->rcorr_given)
314 write_into_file(outfile, "rcorr", 0, 0 );
315 if (args_info->vcorr_given)
316 write_into_file(outfile, "vcorr", 0, 0 );
317 if (args_info->dcorr_given)
318 write_into_file(outfile, "dcorr", 0, 0 );
319 if (args_info->lcorr_given)
320 write_into_file(outfile, "lcorr", 0, 0 );
321 if (args_info->lcorrZ_given)
322 write_into_file(outfile, "lcorrZ", 0, 0 );
323 if (args_info->cohZ_given)
324 write_into_file(outfile, "cohZ", 0, 0 );
325 if (args_info->sdcorr_given)
326 write_into_file(outfile, "sdcorr", 0, 0 );
327 if (args_info->r_rcorr_given)
328 write_into_file(outfile, "r_rcorr", 0, 0 );
329 if (args_info->thetacorr_given)
330 write_into_file(outfile, "thetacorr", 0, 0 );
331 if (args_info->drcorr_given)
332 write_into_file(outfile, "drcorr", 0, 0 );
333 if (args_info->helfandEcorr_given)
334 write_into_file(outfile, "helfandEcorr", 0, 0 );
335 if (args_info->momentum_given)
336 write_into_file(outfile, "momentum", 0, 0 );
337 if (args_info->stresscorr_given)
338 write_into_file(outfile, "stresscorr", 0, 0 );
339
340
341 i = EXIT_SUCCESS;
342 return i;
343 }
344
345 int
346 cmdline_parser_file_save(const char *filename, struct gengetopt_args_info *args_info)
347 {
348 FILE *outfile;
349 int i = 0;
350
351 outfile = fopen(filename, "w");
352
353 if (!outfile)
354 {
355 fprintf (stderr, "%s: cannot open file for writing: %s\n", CMDLINE_PARSER_PACKAGE, filename);
356 return EXIT_FAILURE;
357 }
358
359 i = cmdline_parser_dump(outfile, args_info);
360 fclose (outfile);
361
362 return i;
363 }
364
365 void
366 cmdline_parser_free (struct gengetopt_args_info *args_info)
367 {
368 cmdline_parser_release (args_info);
369 }
370
371 /** @brief replacement of strdup, which is not standard */
372 char *
373 gengetopt_strdup (const char *s)
374 {
375 char *result = 0;
376 if (!s)
377 return result;
378
379 result = (char*)malloc(strlen(s) + 1);
380 if (result == (char*)0)
381 return (char*)0;
382 strcpy(result, s);
383 return result;
384 }
385
386 static void
387 reset_group_dynamicProps(struct gengetopt_args_info *args_info)
388 {
389 if (! args_info->dynamicProps_group_counter)
390 return;
391
392 args_info->selecorr_given = 0 ;
393 args_info->rcorr_given = 0 ;
394 args_info->vcorr_given = 0 ;
395 args_info->dcorr_given = 0 ;
396 args_info->lcorr_given = 0 ;
397 args_info->lcorrZ_given = 0 ;
398 args_info->cohZ_given = 0 ;
399 args_info->sdcorr_given = 0 ;
400 args_info->r_rcorr_given = 0 ;
401 args_info->thetacorr_given = 0 ;
402 args_info->drcorr_given = 0 ;
403 args_info->helfandEcorr_given = 0 ;
404 args_info->momentum_given = 0 ;
405 args_info->stresscorr_given = 0 ;
406
407 args_info->dynamicProps_group_counter = 0;
408 }
409
410 int
411 cmdline_parser (int argc, char **argv, struct gengetopt_args_info *args_info)
412 {
413 return cmdline_parser2 (argc, argv, args_info, 0, 1, 1);
414 }
415
416 int
417 cmdline_parser_ext (int argc, char **argv, struct gengetopt_args_info *args_info,
418 struct cmdline_parser_params *params)
419 {
420 int result;
421 result = cmdline_parser_internal (argc, argv, args_info, params, 0);
422
423 if (result == EXIT_FAILURE)
424 {
425 cmdline_parser_free (args_info);
426 exit (EXIT_FAILURE);
427 }
428
429 return result;
430 }
431
432 int
433 cmdline_parser2 (int argc, char **argv, struct gengetopt_args_info *args_info, int override, int initialize, int check_required)
434 {
435 int result;
436 struct cmdline_parser_params params;
437
438 params.override = override;
439 params.initialize = initialize;
440 params.check_required = check_required;
441 params.check_ambiguity = 0;
442 params.print_errors = 1;
443
444 result = cmdline_parser_internal (argc, argv, args_info, &params, 0);
445
446 if (result == EXIT_FAILURE)
447 {
448 cmdline_parser_free (args_info);
449 exit (EXIT_FAILURE);
450 }
451
452 return result;
453 }
454
455 int
456 cmdline_parser_required (struct gengetopt_args_info *args_info, const char *prog_name)
457 {
458 int result = EXIT_SUCCESS;
459
460 if (cmdline_parser_required2(args_info, prog_name, 0) > 0)
461 result = EXIT_FAILURE;
462
463 if (result == EXIT_FAILURE)
464 {
465 cmdline_parser_free (args_info);
466 exit (EXIT_FAILURE);
467 }
468
469 return result;
470 }
471
472 int
473 cmdline_parser_required2 (struct gengetopt_args_info *args_info, const char *prog_name, const char *additional_error)
474 {
475 int error = 0;
476 FIX_UNUSED (additional_error);
477
478 /* checks for required options */
479 if (! args_info->input_given)
480 {
481 fprintf (stderr, "%s: '--input' ('-i') option required%s\n", prog_name, (additional_error ? additional_error : ""));
482 error = 1;
483 }
484
485 if (args_info->dynamicProps_group_counter == 0)
486 {
487 fprintf (stderr, "%s: %d options of group dynamicProps were given. One is required%s.\n", prog_name, args_info->dynamicProps_group_counter, (additional_error ? additional_error : ""));
488 error = 1;
489 }
490
491
492 /* checks for dependences among options */
493
494 return error;
495 }
496
497
498 static char *package_name = 0;
499
500 /**
501 * @brief updates an option
502 * @param field the generic pointer to the field to update
503 * @param orig_field the pointer to the orig field
504 * @param field_given the pointer to the number of occurrence of this option
505 * @param prev_given the pointer to the number of occurrence already seen
506 * @param value the argument for this option (if null no arg was specified)
507 * @param possible_values the possible values for this option (if specified)
508 * @param default_value the default value (in case the option only accepts fixed values)
509 * @param arg_type the type of this option
510 * @param check_ambiguity @see cmdline_parser_params.check_ambiguity
511 * @param override @see cmdline_parser_params.override
512 * @param no_free whether to free a possible previous value
513 * @param multiple_option whether this is a multiple option
514 * @param long_opt the corresponding long option
515 * @param short_opt the corresponding short option (or '-' if none)
516 * @param additional_error possible further error specification
517 */
518 static
519 int update_arg(void *field, char **orig_field,
520 unsigned int *field_given, unsigned int *prev_given,
521 char *value, const char *possible_values[],
522 const char *default_value,
523 cmdline_parser_arg_type arg_type,
524 int check_ambiguity, int override,
525 int no_free, int multiple_option,
526 const char *long_opt, char short_opt,
527 const char *additional_error)
528 {
529 char *stop_char = 0;
530 const char *val = value;
531 int found;
532 char **string_field;
533 FIX_UNUSED (field);
534
535 stop_char = 0;
536 found = 0;
537
538 if (!multiple_option && prev_given && (*prev_given || (check_ambiguity && *field_given)))
539 {
540 if (short_opt != '-')
541 fprintf (stderr, "%s: `--%s' (`-%c') option given more than once%s\n",
542 package_name, long_opt, short_opt,
543 (additional_error ? additional_error : ""));
544 else
545 fprintf (stderr, "%s: `--%s' option given more than once%s\n",
546 package_name, long_opt,
547 (additional_error ? additional_error : ""));
548 return 1; /* failure */
549 }
550
551 FIX_UNUSED (default_value);
552
553 if (field_given && *field_given && ! override)
554 return 0;
555 if (prev_given)
556 (*prev_given)++;
557 if (field_given)
558 (*field_given)++;
559 if (possible_values)
560 val = possible_values[found];
561
562 switch(arg_type) {
563 case ARG_INT:
564 if (val) *((int *)field) = strtol (val, &stop_char, 0);
565 break;
566 case ARG_STRING:
567 if (val) {
568 string_field = (char **)field;
569 if (!no_free && *string_field)
570 free (*string_field); /* free previous string */
571 *string_field = gengetopt_strdup (val);
572 }
573 break;
574 default:
575 break;
576 };
577
578 /* check numeric conversion */
579 switch(arg_type) {
580 case ARG_INT:
581 if (val && !(stop_char && *stop_char == '\0')) {
582 fprintf(stderr, "%s: invalid numeric value: %s\n", package_name, val);
583 return 1; /* failure */
584 }
585 break;
586 default:
587 ;
588 };
589
590 /* store the original value */
591 switch(arg_type) {
592 case ARG_NO:
593 break;
594 default:
595 if (value && orig_field) {
596 if (no_free) {
597 *orig_field = value;
598 } else {
599 if (*orig_field)
600 free (*orig_field); /* free previous string */
601 *orig_field = gengetopt_strdup (value);
602 }
603 }
604 };
605
606 return 0; /* OK */
607 }
608
609
610 int
611 cmdline_parser_internal (
612 int argc, char **argv, struct gengetopt_args_info *args_info,
613 struct cmdline_parser_params *params, const char *additional_error)
614 {
615 int c; /* Character of the parsed option. */
616
617 int error = 0;
618 struct gengetopt_args_info local_args_info;
619
620 int override;
621 int initialize;
622 int check_required;
623 int check_ambiguity;
624
625 package_name = argv[0];
626
627 override = params->override;
628 initialize = params->initialize;
629 check_required = params->check_required;
630 check_ambiguity = params->check_ambiguity;
631
632 if (initialize)
633 cmdline_parser_init (args_info);
634
635 cmdline_parser_init (&local_args_info);
636
637 optarg = 0;
638 optind = 0;
639 opterr = params->print_errors;
640 optopt = '?';
641
642 while (1)
643 {
644 int option_index = 0;
645
646 static struct option long_options[] = {
647 { "help", 0, NULL, 'h' },
648 { "version", 0, NULL, 'V' },
649 { "input", 1, NULL, 'i' },
650 { "output", 1, NULL, 'o' },
651 { "sele1", 1, NULL, 0 },
652 { "sele2", 1, NULL, 0 },
653 { "order", 1, NULL, 0 },
654 { "nzbins", 1, NULL, 'z' },
655 { "memory", 1, NULL, 'm' },
656 { "selecorr", 0, NULL, 's' },
657 { "rcorr", 0, NULL, 'r' },
658 { "vcorr", 0, NULL, 'v' },
659 { "dcorr", 0, NULL, 'd' },
660 { "lcorr", 0, NULL, 'l' },
661 { "lcorrZ", 0, NULL, 0 },
662 { "cohZ", 0, NULL, 0 },
663 { "sdcorr", 0, NULL, 'M' },
664 { "r_rcorr", 0, NULL, 0 },
665 { "thetacorr", 0, NULL, 0 },
666 { "drcorr", 0, NULL, 0 },
667 { "helfandEcorr", 0, NULL, 0 },
668 { "momentum", 0, NULL, 'p' },
669 { "stresscorr", 0, NULL, 0 },
670 { 0, 0, 0, 0 }
671 };
672
673 c = getopt_long (argc, argv, "hVi:o:z:m:srvdlMp", long_options, &option_index);
674
675 if (c == -1) break; /* Exit from `while (1)' loop. */
676
677 switch (c)
678 {
679 case 'h': /* Print help and exit. */
680 cmdline_parser_print_help ();
681 cmdline_parser_free (&local_args_info);
682 exit (EXIT_SUCCESS);
683
684 case 'V': /* Print version and exit. */
685 cmdline_parser_print_version ();
686 cmdline_parser_free (&local_args_info);
687 exit (EXIT_SUCCESS);
688
689 case 'i': /* input dump file. */
690
691
692 if (update_arg( (void *)&(args_info->input_arg),
693 &(args_info->input_orig), &(args_info->input_given),
694 &(local_args_info.input_given), optarg, 0, 0, ARG_STRING,
695 check_ambiguity, override, 0, 0,
696 "input", 'i',
697 additional_error))
698 goto failure;
699
700 break;
701 case 'o': /* output file name. */
702
703
704 if (update_arg( (void *)&(args_info->output_arg),
705 &(args_info->output_orig), &(args_info->output_given),
706 &(local_args_info.output_given), optarg, 0, 0, ARG_STRING,
707 check_ambiguity, override, 0, 0,
708 "output", 'o',
709 additional_error))
710 goto failure;
711
712 break;
713 case 'z': /* Number of Z bins. */
714
715
716 if (update_arg( (void *)&(args_info->nzbins_arg),
717 &(args_info->nzbins_orig), &(args_info->nzbins_given),
718 &(local_args_info.nzbins_given), optarg, 0, "100", ARG_INT,
719 check_ambiguity, override, 0, 0,
720 "nzbins", 'z',
721 additional_error))
722 goto failure;
723
724 break;
725 case 'm': /* Available memory (defaults to 2G). */
726
727
728 if (update_arg( (void *)&(args_info->memory_arg),
729 &(args_info->memory_orig), &(args_info->memory_given),
730 &(local_args_info.memory_given), optarg, 0, "2G", ARG_STRING,
731 check_ambiguity, override, 0, 0,
732 "memory", 'm',
733 additional_error))
734 goto failure;
735
736 break;
737 case 's': /* selection correlation function. */
738
739 if (args_info->dynamicProps_group_counter && override)
740 reset_group_dynamicProps (args_info);
741 args_info->dynamicProps_group_counter += 1;
742
743 if (update_arg( 0 ,
744 0 , &(args_info->selecorr_given),
745 &(local_args_info.selecorr_given), optarg, 0, 0, ARG_NO,
746 check_ambiguity, override, 0, 0,
747 "selecorr", 's',
748 additional_error))
749 goto failure;
750
751 break;
752 case 'r': /* rmsd. */
753
754 if (args_info->dynamicProps_group_counter && override)
755 reset_group_dynamicProps (args_info);
756 args_info->dynamicProps_group_counter += 1;
757
758 if (update_arg( 0 ,
759 0 , &(args_info->rcorr_given),
760 &(local_args_info.rcorr_given), optarg, 0, 0, ARG_NO,
761 check_ambiguity, override, 0, 0,
762 "rcorr", 'r',
763 additional_error))
764 goto failure;
765
766 break;
767 case 'v': /* velocity correlation function. */
768
769 if (args_info->dynamicProps_group_counter && override)
770 reset_group_dynamicProps (args_info);
771 args_info->dynamicProps_group_counter += 1;
772
773 if (update_arg( 0 ,
774 0 , &(args_info->vcorr_given),
775 &(local_args_info.vcorr_given), optarg, 0, 0, ARG_NO,
776 check_ambiguity, override, 0, 0,
777 "vcorr", 'v',
778 additional_error))
779 goto failure;
780
781 break;
782 case 'd': /* dipole correlation function. */
783
784 if (args_info->dynamicProps_group_counter && override)
785 reset_group_dynamicProps (args_info);
786 args_info->dynamicProps_group_counter += 1;
787
788 if (update_arg( 0 ,
789 0 , &(args_info->dcorr_given),
790 &(local_args_info.dcorr_given), optarg, 0, 0, ARG_NO,
791 check_ambiguity, override, 0, 0,
792 "dcorr", 'd',
793 additional_error))
794 goto failure;
795
796 break;
797 case 'l': /* Lengendre correlation function. */
798
799 if (args_info->dynamicProps_group_counter && override)
800 reset_group_dynamicProps (args_info);
801 args_info->dynamicProps_group_counter += 1;
802
803 if (update_arg( 0 ,
804 0 , &(args_info->lcorr_given),
805 &(local_args_info.lcorr_given), optarg, 0, 0, ARG_NO,
806 check_ambiguity, override, 0, 0,
807 "lcorr", 'l',
808 additional_error))
809 goto failure;
810
811 break;
812 case 'M': /* System dipole correlation function. */
813
814 if (args_info->dynamicProps_group_counter && override)
815 reset_group_dynamicProps (args_info);
816 args_info->dynamicProps_group_counter += 1;
817
818 if (update_arg( 0 ,
819 0 , &(args_info->sdcorr_given),
820 &(local_args_info.sdcorr_given), optarg, 0, 0, ARG_NO,
821 check_ambiguity, override, 0, 0,
822 "sdcorr", 'M',
823 additional_error))
824 goto failure;
825
826 break;
827 case 'p': /* Helfand momentum for viscosity. */
828
829 if (args_info->dynamicProps_group_counter && override)
830 reset_group_dynamicProps (args_info);
831 args_info->dynamicProps_group_counter += 1;
832
833 if (update_arg( 0 ,
834 0 , &(args_info->momentum_given),
835 &(local_args_info.momentum_given), optarg, 0, 0, ARG_NO,
836 check_ambiguity, override, 0, 0,
837 "momentum", 'p',
838 additional_error))
839 goto failure;
840
841 break;
842
843 case 0: /* Long option with no short option */
844 /* select first stuntdouble set. */
845 if (strcmp (long_options[option_index].name, "sele1") == 0)
846 {
847
848
849 if (update_arg( (void *)&(args_info->sele1_arg),
850 &(args_info->sele1_orig), &(args_info->sele1_given),
851 &(local_args_info.sele1_given), optarg, 0, 0, ARG_STRING,
852 check_ambiguity, override, 0, 0,
853 "sele1", '-',
854 additional_error))
855 goto failure;
856
857 }
858 /* select second stuntdouble set (if sele2 is not set, use script from sele1). */
859 else if (strcmp (long_options[option_index].name, "sele2") == 0)
860 {
861
862
863 if (update_arg( (void *)&(args_info->sele2_arg),
864 &(args_info->sele2_orig), &(args_info->sele2_given),
865 &(local_args_info.sele2_given), optarg, 0, 0, ARG_STRING,
866 check_ambiguity, override, 0, 0,
867 "sele2", '-',
868 additional_error))
869 goto failure;
870
871 }
872 /* Lengendre Polynomial Order. */
873 else if (strcmp (long_options[option_index].name, "order") == 0)
874 {
875
876
877 if (update_arg( (void *)&(args_info->order_arg),
878 &(args_info->order_orig), &(args_info->order_given),
879 &(local_args_info.order_given), optarg, 0, 0, ARG_INT,
880 check_ambiguity, override, 0, 0,
881 "order", '-',
882 additional_error))
883 goto failure;
884
885 }
886 /* Lengendre correlation function binned by Z. */
887 else if (strcmp (long_options[option_index].name, "lcorrZ") == 0)
888 {
889
890 if (args_info->dynamicProps_group_counter && override)
891 reset_group_dynamicProps (args_info);
892 args_info->dynamicProps_group_counter += 1;
893
894 if (update_arg( 0 ,
895 0 , &(args_info->lcorrZ_given),
896 &(local_args_info.lcorrZ_given), optarg, 0, 0, ARG_NO,
897 check_ambiguity, override, 0, 0,
898 "lcorrZ", '-',
899 additional_error))
900 goto failure;
901
902 }
903 /* Lengendre correlation function for OH bond vectors binned by Z. */
904 else if (strcmp (long_options[option_index].name, "cohZ") == 0)
905 {
906
907 if (args_info->dynamicProps_group_counter && override)
908 reset_group_dynamicProps (args_info);
909 args_info->dynamicProps_group_counter += 1;
910
911 if (update_arg( 0 ,
912 0 , &(args_info->cohZ_given),
913 &(local_args_info.cohZ_given), optarg, 0, 0, ARG_NO,
914 check_ambiguity, override, 0, 0,
915 "cohZ", '-',
916 additional_error))
917 goto failure;
918
919 }
920 /* Radial rmsd. */
921 else if (strcmp (long_options[option_index].name, "r_rcorr") == 0)
922 {
923
924 if (args_info->dynamicProps_group_counter && override)
925 reset_group_dynamicProps (args_info);
926 args_info->dynamicProps_group_counter += 1;
927
928 if (update_arg( 0 ,
929 0 , &(args_info->r_rcorr_given),
930 &(local_args_info.r_rcorr_given), optarg, 0, 0, ARG_NO,
931 check_ambiguity, override, 0, 0,
932 "r_rcorr", '-',
933 additional_error))
934 goto failure;
935
936 }
937 /* Angular rmsd. */
938 else if (strcmp (long_options[option_index].name, "thetacorr") == 0)
939 {
940
941 if (args_info->dynamicProps_group_counter && override)
942 reset_group_dynamicProps (args_info);
943 args_info->dynamicProps_group_counter += 1;
944
945 if (update_arg( 0 ,
946 0 , &(args_info->thetacorr_given),
947 &(local_args_info.thetacorr_given), optarg, 0, 0, ARG_NO,
948 check_ambiguity, override, 0, 0,
949 "thetacorr", '-',
950 additional_error))
951 goto failure;
952
953 }
954 /* Directional rmsd for particles with unit vectors. */
955 else if (strcmp (long_options[option_index].name, "drcorr") == 0)
956 {
957
958 if (args_info->dynamicProps_group_counter && override)
959 reset_group_dynamicProps (args_info);
960 args_info->dynamicProps_group_counter += 1;
961
962 if (update_arg( 0 ,
963 0 , &(args_info->drcorr_given),
964 &(local_args_info.drcorr_given), optarg, 0, 0, ARG_NO,
965 check_ambiguity, override, 0, 0,
966 "drcorr", '-',
967 additional_error))
968 goto failure;
969
970 }
971 /* Helfand moment for thermal conductvity. */
972 else if (strcmp (long_options[option_index].name, "helfandEcorr") == 0)
973 {
974
975 if (args_info->dynamicProps_group_counter && override)
976 reset_group_dynamicProps (args_info);
977 args_info->dynamicProps_group_counter += 1;
978
979 if (update_arg( 0 ,
980 0 , &(args_info->helfandEcorr_given),
981 &(local_args_info.helfandEcorr_given), optarg, 0, 0, ARG_NO,
982 check_ambiguity, override, 0, 0,
983 "helfandEcorr", '-',
984 additional_error))
985 goto failure;
986
987 }
988 /* Stress tensor correlation function. */
989 else if (strcmp (long_options[option_index].name, "stresscorr") == 0)
990 {
991
992 if (args_info->dynamicProps_group_counter && override)
993 reset_group_dynamicProps (args_info);
994 args_info->dynamicProps_group_counter += 1;
995
996 if (update_arg( 0 ,
997 0 , &(args_info->stresscorr_given),
998 &(local_args_info.stresscorr_given), optarg, 0, 0, ARG_NO,
999 check_ambiguity, override, 0, 0,
1000 "stresscorr", '-',
1001 additional_error))
1002 goto failure;
1003
1004 }
1005
1006 break;
1007 case '?': /* Invalid option. */
1008 /* `getopt_long' already printed an error message. */
1009 goto failure;
1010
1011 default: /* bug: option not considered. */
1012 fprintf (stderr, "%s: option unknown: %c%s\n", CMDLINE_PARSER_PACKAGE, c, (additional_error ? additional_error : ""));
1013 abort ();
1014 } /* switch */
1015 } /* while */
1016
1017 if (args_info->dynamicProps_group_counter > 1)
1018 {
1019 fprintf (stderr, "%s: %d options of group dynamicProps were given. One is required%s.\n", argv[0], args_info->dynamicProps_group_counter, (additional_error ? additional_error : ""));
1020 error = 1;
1021 }
1022
1023
1024
1025 if (check_required)
1026 {
1027 error += cmdline_parser_required2 (args_info, argv[0], additional_error);
1028 }
1029
1030 cmdline_parser_release (&local_args_info);
1031
1032 if ( error )
1033 return (EXIT_FAILURE);
1034
1035 if (optind < argc)
1036 {
1037 int i = 0 ;
1038 int found_prog_name = 0;
1039 /* whether program name, i.e., argv[0], is in the remaining args
1040 (this may happen with some implementations of getopt,
1041 but surely not with the one included by gengetopt) */
1042
1043 i = optind;
1044 while (i < argc)
1045 if (argv[i++] == argv[0]) {
1046 found_prog_name = 1;
1047 break;
1048 }
1049 i = 0;
1050
1051 args_info->inputs_num = argc - optind - found_prog_name;
1052 args_info->inputs =
1053 (char **)(malloc ((args_info->inputs_num)*sizeof(char *))) ;
1054 while (optind < argc)
1055 if (argv[optind++] != argv[0])
1056 args_info->inputs[ i++ ] = gengetopt_strdup (argv[optind-1]) ;
1057 }
1058
1059 return 0;
1060
1061 failure:
1062
1063 cmdline_parser_release (&local_args_info);
1064 return (EXIT_FAILURE);
1065 }

Properties

Name Value
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