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root/OpenMD/trunk/src/applications/sequentialProps/SequentialPropsCmd.cpp
Revision: 2081
Committed: Tue Mar 17 18:22:18 2015 UTC (10 years, 1 month ago) by gezelter
File size: 28392 byte(s)
Log Message:
ContactAngle2 now requires specification of the location of the 
droplet centroid in X&Y axes.

File Contents

# User Rev Content
1 gezelter 2024 /*
2     File autogenerated by gengetopt version 2.22.4
3     generated with the following command:
4     gengetopt --file-name=SequentialPropsCmd --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 "SequentialPropsCmd.h"
31    
32     const char *gengetopt_args_info_purpose = "";
33    
34     const char *gengetopt_args_info_usage = "Usage: SequentialProps [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 gezelter 2035 " -b, --nbins=INT number of bins (general purpose) \n (default=`100')",
46     " --nbins_z=INT number of bins in z axis (default=`100')",
47 gezelter 2081 " -x, --centroidX=DOUBLE Location of droplet centroid in x",
48     " -y, --centroidY=DOUBLE Location of droplet centroid in y",
49 gezelter 2029 " -z, --referenceZ=DOUBLE Reference z-height of solid surface",
50     " -r, --dropletR=DOUBLE Droplet radius in angstroms",
51 gezelter 2035 " --threshDens=DOUBLE Threshold Density in g/cm^3",
52 gezelter 2039 " --bufferLength=DOUBLE Buffer length in angstroms",
53 gezelter 2024 "\n Group: sequentialProps\n an option of this group is required",
54 gezelter 2029 " -c, --com selection center of mass",
55     " --ca1 contact angle of selection (using center of \n mass)",
56     " --ca2 contact angle of selection (using density \n profile)",
57 gezelter 2024 0
58     };
59    
60     typedef enum {ARG_NO
61     , ARG_STRING
62     , ARG_INT
63 gezelter 2029 , ARG_DOUBLE
64 gezelter 2024 } cmdline_parser_arg_type;
65    
66     static
67     void clear_given (struct gengetopt_args_info *args_info);
68     static
69     void clear_args (struct gengetopt_args_info *args_info);
70    
71     static int
72     cmdline_parser_internal (int argc, char **argv, struct gengetopt_args_info *args_info,
73     struct cmdline_parser_params *params, const char *additional_error);
74    
75     static int
76     cmdline_parser_required2 (struct gengetopt_args_info *args_info, const char *prog_name, const char *additional_error);
77    
78     static char *
79     gengetopt_strdup (const char *s);
80    
81     static
82     void clear_given (struct gengetopt_args_info *args_info)
83     {
84     args_info->help_given = 0 ;
85     args_info->version_given = 0 ;
86     args_info->input_given = 0 ;
87     args_info->output_given = 0 ;
88     args_info->sele1_given = 0 ;
89     args_info->sele2_given = 0 ;
90     args_info->nbins_given = 0 ;
91 gezelter 2035 args_info->nbins_z_given = 0 ;
92 gezelter 2081 args_info->centroidX_given = 0 ;
93     args_info->centroidY_given = 0 ;
94 gezelter 2029 args_info->referenceZ_given = 0 ;
95     args_info->dropletR_given = 0 ;
96 gezelter 2035 args_info->threshDens_given = 0 ;
97 gezelter 2039 args_info->bufferLength_given = 0 ;
98 gezelter 2029 args_info->com_given = 0 ;
99     args_info->ca1_given = 0 ;
100     args_info->ca2_given = 0 ;
101 gezelter 2024 args_info->sequentialProps_group_counter = 0 ;
102     }
103    
104     static
105     void clear_args (struct gengetopt_args_info *args_info)
106     {
107     FIX_UNUSED (args_info);
108     args_info->input_arg = NULL;
109     args_info->input_orig = NULL;
110     args_info->output_arg = NULL;
111     args_info->output_orig = NULL;
112     args_info->sele1_arg = NULL;
113     args_info->sele1_orig = NULL;
114     args_info->sele2_arg = NULL;
115     args_info->sele2_orig = NULL;
116     args_info->nbins_arg = 100;
117     args_info->nbins_orig = NULL;
118 gezelter 2035 args_info->nbins_z_arg = 100;
119     args_info->nbins_z_orig = NULL;
120 gezelter 2081 args_info->centroidX_orig = NULL;
121     args_info->centroidY_orig = NULL;
122 gezelter 2029 args_info->referenceZ_orig = NULL;
123     args_info->dropletR_orig = NULL;
124 gezelter 2035 args_info->threshDens_orig = NULL;
125 gezelter 2039 args_info->bufferLength_orig = NULL;
126 gezelter 2024
127     }
128    
129     static
130     void init_args_info(struct gengetopt_args_info *args_info)
131     {
132    
133    
134     args_info->help_help = gengetopt_args_info_help[0] ;
135     args_info->version_help = gengetopt_args_info_help[1] ;
136     args_info->input_help = gengetopt_args_info_help[2] ;
137     args_info->output_help = gengetopt_args_info_help[3] ;
138     args_info->sele1_help = gengetopt_args_info_help[4] ;
139     args_info->sele2_help = gengetopt_args_info_help[5] ;
140     args_info->nbins_help = gengetopt_args_info_help[6] ;
141 gezelter 2035 args_info->nbins_z_help = gengetopt_args_info_help[7] ;
142 gezelter 2081 args_info->centroidX_help = gengetopt_args_info_help[8] ;
143     args_info->centroidY_help = gengetopt_args_info_help[9] ;
144     args_info->referenceZ_help = gengetopt_args_info_help[10] ;
145     args_info->dropletR_help = gengetopt_args_info_help[11] ;
146     args_info->threshDens_help = gengetopt_args_info_help[12] ;
147     args_info->bufferLength_help = gengetopt_args_info_help[13] ;
148     args_info->com_help = gengetopt_args_info_help[15] ;
149     args_info->ca1_help = gengetopt_args_info_help[16] ;
150     args_info->ca2_help = gengetopt_args_info_help[17] ;
151 gezelter 2024
152     }
153    
154     void
155     cmdline_parser_print_version (void)
156     {
157     printf ("%s %s\n",
158     (strlen(CMDLINE_PARSER_PACKAGE_NAME) ? CMDLINE_PARSER_PACKAGE_NAME : CMDLINE_PARSER_PACKAGE),
159     CMDLINE_PARSER_VERSION);
160     }
161    
162     static void print_help_common(void) {
163     cmdline_parser_print_version ();
164    
165     if (strlen(gengetopt_args_info_purpose) > 0)
166     printf("\n%s\n", gengetopt_args_info_purpose);
167    
168     if (strlen(gengetopt_args_info_usage) > 0)
169     printf("\n%s\n", gengetopt_args_info_usage);
170    
171     printf("\n");
172    
173     if (strlen(gengetopt_args_info_description) > 0)
174     printf("%s\n\n", gengetopt_args_info_description);
175     }
176    
177     void
178     cmdline_parser_print_help (void)
179     {
180     int i = 0;
181     print_help_common();
182     while (gengetopt_args_info_help[i])
183     printf("%s\n", gengetopt_args_info_help[i++]);
184     }
185    
186     void
187     cmdline_parser_init (struct gengetopt_args_info *args_info)
188     {
189     clear_given (args_info);
190     clear_args (args_info);
191     init_args_info (args_info);
192    
193     args_info->inputs = 0;
194     args_info->inputs_num = 0;
195     }
196    
197     void
198     cmdline_parser_params_init(struct cmdline_parser_params *params)
199     {
200     if (params)
201     {
202     params->override = 0;
203     params->initialize = 1;
204     params->check_required = 1;
205     params->check_ambiguity = 0;
206     params->print_errors = 1;
207     }
208     }
209    
210     struct cmdline_parser_params *
211     cmdline_parser_params_create(void)
212     {
213     struct cmdline_parser_params *params =
214     (struct cmdline_parser_params *)malloc(sizeof(struct cmdline_parser_params));
215     cmdline_parser_params_init(params);
216     return params;
217     }
218    
219     static void
220     free_string_field (char **s)
221     {
222     if (*s)
223     {
224     free (*s);
225     *s = 0;
226     }
227     }
228    
229    
230     static void
231     cmdline_parser_release (struct gengetopt_args_info *args_info)
232     {
233     unsigned int i;
234     free_string_field (&(args_info->input_arg));
235     free_string_field (&(args_info->input_orig));
236     free_string_field (&(args_info->output_arg));
237     free_string_field (&(args_info->output_orig));
238     free_string_field (&(args_info->sele1_arg));
239     free_string_field (&(args_info->sele1_orig));
240     free_string_field (&(args_info->sele2_arg));
241     free_string_field (&(args_info->sele2_orig));
242     free_string_field (&(args_info->nbins_orig));
243 gezelter 2035 free_string_field (&(args_info->nbins_z_orig));
244 gezelter 2081 free_string_field (&(args_info->centroidX_orig));
245     free_string_field (&(args_info->centroidY_orig));
246 gezelter 2029 free_string_field (&(args_info->referenceZ_orig));
247     free_string_field (&(args_info->dropletR_orig));
248 gezelter 2035 free_string_field (&(args_info->threshDens_orig));
249 gezelter 2039 free_string_field (&(args_info->bufferLength_orig));
250 gezelter 2024
251    
252     for (i = 0; i < args_info->inputs_num; ++i)
253     free (args_info->inputs [i]);
254    
255     if (args_info->inputs_num)
256     free (args_info->inputs);
257    
258     clear_given (args_info);
259     }
260    
261    
262     static void
263     write_into_file(FILE *outfile, const char *opt, const char *arg, const char *values[])
264     {
265     FIX_UNUSED (values);
266     if (arg) {
267     fprintf(outfile, "%s=\"%s\"\n", opt, arg);
268     } else {
269     fprintf(outfile, "%s\n", opt);
270     }
271     }
272    
273    
274     int
275     cmdline_parser_dump(FILE *outfile, struct gengetopt_args_info *args_info)
276     {
277     int i = 0;
278    
279     if (!outfile)
280     {
281     fprintf (stderr, "%s: cannot dump options to stream\n", CMDLINE_PARSER_PACKAGE);
282     return EXIT_FAILURE;
283     }
284    
285     if (args_info->help_given)
286     write_into_file(outfile, "help", 0, 0 );
287     if (args_info->version_given)
288     write_into_file(outfile, "version", 0, 0 );
289     if (args_info->input_given)
290     write_into_file(outfile, "input", args_info->input_orig, 0);
291     if (args_info->output_given)
292     write_into_file(outfile, "output", args_info->output_orig, 0);
293     if (args_info->sele1_given)
294     write_into_file(outfile, "sele1", args_info->sele1_orig, 0);
295     if (args_info->sele2_given)
296     write_into_file(outfile, "sele2", args_info->sele2_orig, 0);
297     if (args_info->nbins_given)
298     write_into_file(outfile, "nbins", args_info->nbins_orig, 0);
299 gezelter 2035 if (args_info->nbins_z_given)
300     write_into_file(outfile, "nbins_z", args_info->nbins_z_orig, 0);
301 gezelter 2081 if (args_info->centroidX_given)
302     write_into_file(outfile, "centroidX", args_info->centroidX_orig, 0);
303     if (args_info->centroidY_given)
304     write_into_file(outfile, "centroidY", args_info->centroidY_orig, 0);
305 gezelter 2029 if (args_info->referenceZ_given)
306     write_into_file(outfile, "referenceZ", args_info->referenceZ_orig, 0);
307     if (args_info->dropletR_given)
308     write_into_file(outfile, "dropletR", args_info->dropletR_orig, 0);
309 gezelter 2035 if (args_info->threshDens_given)
310     write_into_file(outfile, "threshDens", args_info->threshDens_orig, 0);
311 gezelter 2039 if (args_info->bufferLength_given)
312     write_into_file(outfile, "bufferLength", args_info->bufferLength_orig, 0);
313 gezelter 2029 if (args_info->com_given)
314     write_into_file(outfile, "com", 0, 0 );
315     if (args_info->ca1_given)
316     write_into_file(outfile, "ca1", 0, 0 );
317     if (args_info->ca2_given)
318     write_into_file(outfile, "ca2", 0, 0 );
319 gezelter 2024
320    
321     i = EXIT_SUCCESS;
322     return i;
323     }
324    
325     int
326     cmdline_parser_file_save(const char *filename, struct gengetopt_args_info *args_info)
327     {
328     FILE *outfile;
329     int i = 0;
330    
331     outfile = fopen(filename, "w");
332    
333     if (!outfile)
334     {
335     fprintf (stderr, "%s: cannot open file for writing: %s\n", CMDLINE_PARSER_PACKAGE, filename);
336     return EXIT_FAILURE;
337     }
338    
339     i = cmdline_parser_dump(outfile, args_info);
340     fclose (outfile);
341    
342     return i;
343     }
344    
345     void
346     cmdline_parser_free (struct gengetopt_args_info *args_info)
347     {
348     cmdline_parser_release (args_info);
349     }
350    
351     /** @brief replacement of strdup, which is not standard */
352     char *
353     gengetopt_strdup (const char *s)
354     {
355     char *result = 0;
356     if (!s)
357     return result;
358    
359     result = (char*)malloc(strlen(s) + 1);
360     if (result == (char*)0)
361     return (char*)0;
362     strcpy(result, s);
363     return result;
364     }
365    
366     static void
367     reset_group_sequentialProps(struct gengetopt_args_info *args_info)
368     {
369     if (! args_info->sequentialProps_group_counter)
370     return;
371    
372 gezelter 2029 args_info->com_given = 0 ;
373     args_info->ca1_given = 0 ;
374     args_info->ca2_given = 0 ;
375 gezelter 2024
376     args_info->sequentialProps_group_counter = 0;
377     }
378    
379     int
380     cmdline_parser (int argc, char **argv, struct gengetopt_args_info *args_info)
381     {
382     return cmdline_parser2 (argc, argv, args_info, 0, 1, 1);
383     }
384    
385     int
386     cmdline_parser_ext (int argc, char **argv, struct gengetopt_args_info *args_info,
387     struct cmdline_parser_params *params)
388     {
389     int result;
390     result = cmdline_parser_internal (argc, argv, args_info, params, 0);
391    
392     if (result == EXIT_FAILURE)
393     {
394     cmdline_parser_free (args_info);
395     exit (EXIT_FAILURE);
396     }
397    
398     return result;
399     }
400    
401     int
402     cmdline_parser2 (int argc, char **argv, struct gengetopt_args_info *args_info, int override, int initialize, int check_required)
403     {
404     int result;
405     struct cmdline_parser_params params;
406    
407     params.override = override;
408     params.initialize = initialize;
409     params.check_required = check_required;
410     params.check_ambiguity = 0;
411     params.print_errors = 1;
412    
413     result = cmdline_parser_internal (argc, argv, args_info, &params, 0);
414    
415     if (result == EXIT_FAILURE)
416     {
417     cmdline_parser_free (args_info);
418     exit (EXIT_FAILURE);
419     }
420    
421     return result;
422     }
423    
424     int
425     cmdline_parser_required (struct gengetopt_args_info *args_info, const char *prog_name)
426     {
427     int result = EXIT_SUCCESS;
428    
429     if (cmdline_parser_required2(args_info, prog_name, 0) > 0)
430     result = EXIT_FAILURE;
431    
432     if (result == EXIT_FAILURE)
433     {
434     cmdline_parser_free (args_info);
435     exit (EXIT_FAILURE);
436     }
437    
438     return result;
439     }
440    
441     int
442     cmdline_parser_required2 (struct gengetopt_args_info *args_info, const char *prog_name, const char *additional_error)
443     {
444     int error = 0;
445     FIX_UNUSED (additional_error);
446    
447     /* checks for required options */
448     if (! args_info->input_given)
449     {
450     fprintf (stderr, "%s: '--input' ('-i') option required%s\n", prog_name, (additional_error ? additional_error : ""));
451     error = 1;
452     }
453    
454     if (args_info->sequentialProps_group_counter == 0)
455     {
456     fprintf (stderr, "%s: %d options of group sequentialProps were given. One is required%s.\n", prog_name, args_info->sequentialProps_group_counter, (additional_error ? additional_error : ""));
457     error = 1;
458     }
459    
460    
461     /* checks for dependences among options */
462    
463     return error;
464     }
465    
466    
467     static char *package_name = 0;
468    
469     /**
470     * @brief updates an option
471     * @param field the generic pointer to the field to update
472     * @param orig_field the pointer to the orig field
473     * @param field_given the pointer to the number of occurrence of this option
474     * @param prev_given the pointer to the number of occurrence already seen
475     * @param value the argument for this option (if null no arg was specified)
476     * @param possible_values the possible values for this option (if specified)
477     * @param default_value the default value (in case the option only accepts fixed values)
478     * @param arg_type the type of this option
479     * @param check_ambiguity @see cmdline_parser_params.check_ambiguity
480     * @param override @see cmdline_parser_params.override
481     * @param no_free whether to free a possible previous value
482     * @param multiple_option whether this is a multiple option
483     * @param long_opt the corresponding long option
484     * @param short_opt the corresponding short option (or '-' if none)
485     * @param additional_error possible further error specification
486     */
487     static
488     int update_arg(void *field, char **orig_field,
489     unsigned int *field_given, unsigned int *prev_given,
490     char *value, const char *possible_values[],
491     const char *default_value,
492     cmdline_parser_arg_type arg_type,
493     int check_ambiguity, int override,
494     int no_free, int multiple_option,
495     const char *long_opt, char short_opt,
496     const char *additional_error)
497     {
498     char *stop_char = 0;
499     const char *val = value;
500     int found;
501     char **string_field;
502     FIX_UNUSED (field);
503    
504     stop_char = 0;
505     found = 0;
506    
507     if (!multiple_option && prev_given && (*prev_given || (check_ambiguity && *field_given)))
508     {
509     if (short_opt != '-')
510     fprintf (stderr, "%s: `--%s' (`-%c') option given more than once%s\n",
511     package_name, long_opt, short_opt,
512     (additional_error ? additional_error : ""));
513     else
514     fprintf (stderr, "%s: `--%s' option given more than once%s\n",
515     package_name, long_opt,
516     (additional_error ? additional_error : ""));
517     return 1; /* failure */
518     }
519    
520     FIX_UNUSED (default_value);
521    
522     if (field_given && *field_given && ! override)
523     return 0;
524     if (prev_given)
525     (*prev_given)++;
526     if (field_given)
527     (*field_given)++;
528     if (possible_values)
529     val = possible_values[found];
530    
531     switch(arg_type) {
532     case ARG_INT:
533     if (val) *((int *)field) = strtol (val, &stop_char, 0);
534     break;
535 gezelter 2029 case ARG_DOUBLE:
536     if (val) *((double *)field) = strtod (val, &stop_char);
537     break;
538 gezelter 2024 case ARG_STRING:
539     if (val) {
540     string_field = (char **)field;
541     if (!no_free && *string_field)
542     free (*string_field); /* free previous string */
543     *string_field = gengetopt_strdup (val);
544     }
545     break;
546     default:
547     break;
548     };
549    
550     /* check numeric conversion */
551     switch(arg_type) {
552     case ARG_INT:
553 gezelter 2029 case ARG_DOUBLE:
554 gezelter 2024 if (val && !(stop_char && *stop_char == '\0')) {
555     fprintf(stderr, "%s: invalid numeric value: %s\n", package_name, val);
556     return 1; /* failure */
557     }
558     break;
559     default:
560     ;
561     };
562    
563     /* store the original value */
564     switch(arg_type) {
565     case ARG_NO:
566     break;
567     default:
568     if (value && orig_field) {
569     if (no_free) {
570     *orig_field = value;
571     } else {
572     if (*orig_field)
573     free (*orig_field); /* free previous string */
574     *orig_field = gengetopt_strdup (value);
575     }
576     }
577     };
578    
579     return 0; /* OK */
580     }
581    
582    
583     int
584     cmdline_parser_internal (
585     int argc, char **argv, struct gengetopt_args_info *args_info,
586     struct cmdline_parser_params *params, const char *additional_error)
587     {
588     int c; /* Character of the parsed option. */
589    
590     int error = 0;
591     struct gengetopt_args_info local_args_info;
592    
593     int override;
594     int initialize;
595     int check_required;
596     int check_ambiguity;
597    
598     package_name = argv[0];
599    
600     override = params->override;
601     initialize = params->initialize;
602     check_required = params->check_required;
603     check_ambiguity = params->check_ambiguity;
604    
605     if (initialize)
606     cmdline_parser_init (args_info);
607    
608     cmdline_parser_init (&local_args_info);
609    
610     optarg = 0;
611     optind = 0;
612     opterr = params->print_errors;
613     optopt = '?';
614    
615     while (1)
616     {
617     int option_index = 0;
618    
619     static struct option long_options[] = {
620     { "help", 0, NULL, 'h' },
621     { "version", 0, NULL, 'V' },
622     { "input", 1, NULL, 'i' },
623     { "output", 1, NULL, 'o' },
624     { "sele1", 1, NULL, 0 },
625     { "sele2", 1, NULL, 0 },
626 gezelter 2035 { "nbins", 1, NULL, 'b' },
627     { "nbins_z", 1, NULL, 0 },
628 gezelter 2081 { "centroidX", 1, NULL, 'x' },
629     { "centroidY", 1, NULL, 'y' },
630 gezelter 2029 { "referenceZ", 1, NULL, 'z' },
631     { "dropletR", 1, NULL, 'r' },
632 gezelter 2035 { "threshDens", 1, NULL, 0 },
633 gezelter 2039 { "bufferLength", 1, NULL, 0 },
634 gezelter 2029 { "com", 0, NULL, 'c' },
635     { "ca1", 0, NULL, 0 },
636     { "ca2", 0, NULL, 0 },
637 gezelter 2024 { 0, 0, 0, 0 }
638     };
639    
640 gezelter 2081 c = getopt_long (argc, argv, "hVi:o:b:x:y:z:r:c", long_options, &option_index);
641 gezelter 2024
642     if (c == -1) break; /* Exit from `while (1)' loop. */
643    
644     switch (c)
645     {
646     case 'h': /* Print help and exit. */
647     cmdline_parser_print_help ();
648     cmdline_parser_free (&local_args_info);
649     exit (EXIT_SUCCESS);
650    
651     case 'V': /* Print version and exit. */
652     cmdline_parser_print_version ();
653     cmdline_parser_free (&local_args_info);
654     exit (EXIT_SUCCESS);
655    
656     case 'i': /* input dump file. */
657    
658    
659     if (update_arg( (void *)&(args_info->input_arg),
660     &(args_info->input_orig), &(args_info->input_given),
661     &(local_args_info.input_given), optarg, 0, 0, ARG_STRING,
662     check_ambiguity, override, 0, 0,
663     "input", 'i',
664     additional_error))
665     goto failure;
666    
667     break;
668     case 'o': /* output file name. */
669    
670    
671     if (update_arg( (void *)&(args_info->output_arg),
672     &(args_info->output_orig), &(args_info->output_given),
673     &(local_args_info.output_given), optarg, 0, 0, ARG_STRING,
674     check_ambiguity, override, 0, 0,
675     "output", 'o',
676     additional_error))
677     goto failure;
678    
679     break;
680 gezelter 2035 case 'b': /* number of bins (general purpose). */
681 gezelter 2024
682    
683     if (update_arg( (void *)&(args_info->nbins_arg),
684     &(args_info->nbins_orig), &(args_info->nbins_given),
685     &(local_args_info.nbins_given), optarg, 0, "100", ARG_INT,
686     check_ambiguity, override, 0, 0,
687 gezelter 2035 "nbins", 'b',
688 gezelter 2024 additional_error))
689     goto failure;
690    
691     break;
692 gezelter 2081 case 'x': /* Location of droplet centroid in x. */
693    
694    
695     if (update_arg( (void *)&(args_info->centroidX_arg),
696     &(args_info->centroidX_orig), &(args_info->centroidX_given),
697     &(local_args_info.centroidX_given), optarg, 0, 0, ARG_DOUBLE,
698     check_ambiguity, override, 0, 0,
699     "centroidX", 'x',
700     additional_error))
701     goto failure;
702    
703     break;
704     case 'y': /* Location of droplet centroid in y. */
705    
706    
707     if (update_arg( (void *)&(args_info->centroidY_arg),
708     &(args_info->centroidY_orig), &(args_info->centroidY_given),
709     &(local_args_info.centroidY_given), optarg, 0, 0, ARG_DOUBLE,
710     check_ambiguity, override, 0, 0,
711     "centroidY", 'y',
712     additional_error))
713     goto failure;
714    
715     break;
716 gezelter 2029 case 'z': /* Reference z-height of solid surface. */
717 gezelter 2024
718 gezelter 2029
719     if (update_arg( (void *)&(args_info->referenceZ_arg),
720     &(args_info->referenceZ_orig), &(args_info->referenceZ_given),
721     &(local_args_info.referenceZ_given), optarg, 0, 0, ARG_DOUBLE,
722     check_ambiguity, override, 0, 0,
723     "referenceZ", 'z',
724     additional_error))
725     goto failure;
726    
727     break;
728     case 'r': /* Droplet radius in angstroms. */
729    
730    
731     if (update_arg( (void *)&(args_info->dropletR_arg),
732     &(args_info->dropletR_orig), &(args_info->dropletR_given),
733     &(local_args_info.dropletR_given), optarg, 0, 0, ARG_DOUBLE,
734     check_ambiguity, override, 0, 0,
735     "dropletR", 'r',
736     additional_error))
737     goto failure;
738    
739     break;
740     case 'c': /* selection center of mass. */
741    
742 gezelter 2024 if (args_info->sequentialProps_group_counter && override)
743     reset_group_sequentialProps (args_info);
744     args_info->sequentialProps_group_counter += 1;
745    
746     if (update_arg( 0 ,
747 gezelter 2029 0 , &(args_info->com_given),
748     &(local_args_info.com_given), optarg, 0, 0, ARG_NO,
749 gezelter 2024 check_ambiguity, override, 0, 0,
750 gezelter 2029 "com", 'c',
751 gezelter 2024 additional_error))
752     goto failure;
753    
754     break;
755    
756     case 0: /* Long option with no short option */
757     /* select first stuntdouble set. */
758     if (strcmp (long_options[option_index].name, "sele1") == 0)
759     {
760    
761    
762     if (update_arg( (void *)&(args_info->sele1_arg),
763     &(args_info->sele1_orig), &(args_info->sele1_given),
764     &(local_args_info.sele1_given), optarg, 0, 0, ARG_STRING,
765     check_ambiguity, override, 0, 0,
766     "sele1", '-',
767     additional_error))
768     goto failure;
769    
770     }
771     /* select second stuntdouble set (if sele2 is not set, use script from sele1). */
772     else if (strcmp (long_options[option_index].name, "sele2") == 0)
773     {
774    
775    
776     if (update_arg( (void *)&(args_info->sele2_arg),
777     &(args_info->sele2_orig), &(args_info->sele2_given),
778     &(local_args_info.sele2_given), optarg, 0, 0, ARG_STRING,
779     check_ambiguity, override, 0, 0,
780     "sele2", '-',
781     additional_error))
782     goto failure;
783    
784     }
785 gezelter 2035 /* number of bins in z axis. */
786     else if (strcmp (long_options[option_index].name, "nbins_z") == 0)
787     {
788    
789    
790     if (update_arg( (void *)&(args_info->nbins_z_arg),
791     &(args_info->nbins_z_orig), &(args_info->nbins_z_given),
792     &(local_args_info.nbins_z_given), optarg, 0, "100", ARG_INT,
793     check_ambiguity, override, 0, 0,
794     "nbins_z", '-',
795     additional_error))
796     goto failure;
797    
798     }
799     /* Threshold Density in g/cm^3. */
800     else if (strcmp (long_options[option_index].name, "threshDens") == 0)
801     {
802    
803    
804     if (update_arg( (void *)&(args_info->threshDens_arg),
805     &(args_info->threshDens_orig), &(args_info->threshDens_given),
806     &(local_args_info.threshDens_given), optarg, 0, 0, ARG_DOUBLE,
807     check_ambiguity, override, 0, 0,
808     "threshDens", '-',
809     additional_error))
810     goto failure;
811    
812     }
813 gezelter 2039 /* Buffer length in angstroms. */
814     else if (strcmp (long_options[option_index].name, "bufferLength") == 0)
815     {
816    
817    
818     if (update_arg( (void *)&(args_info->bufferLength_arg),
819     &(args_info->bufferLength_orig), &(args_info->bufferLength_given),
820     &(local_args_info.bufferLength_given), optarg, 0, 0, ARG_DOUBLE,
821     check_ambiguity, override, 0, 0,
822     "bufferLength", '-',
823     additional_error))
824     goto failure;
825    
826     }
827 gezelter 2029 /* contact angle of selection (using center of mass). */
828     else if (strcmp (long_options[option_index].name, "ca1") == 0)
829     {
830 gezelter 2024
831 gezelter 2029 if (args_info->sequentialProps_group_counter && override)
832     reset_group_sequentialProps (args_info);
833     args_info->sequentialProps_group_counter += 1;
834    
835     if (update_arg( 0 ,
836     0 , &(args_info->ca1_given),
837     &(local_args_info.ca1_given), optarg, 0, 0, ARG_NO,
838     check_ambiguity, override, 0, 0,
839     "ca1", '-',
840     additional_error))
841     goto failure;
842    
843     }
844     /* contact angle of selection (using density profile). */
845     else if (strcmp (long_options[option_index].name, "ca2") == 0)
846     {
847    
848     if (args_info->sequentialProps_group_counter && override)
849     reset_group_sequentialProps (args_info);
850     args_info->sequentialProps_group_counter += 1;
851    
852     if (update_arg( 0 ,
853     0 , &(args_info->ca2_given),
854     &(local_args_info.ca2_given), optarg, 0, 0, ARG_NO,
855     check_ambiguity, override, 0, 0,
856     "ca2", '-',
857     additional_error))
858     goto failure;
859    
860     }
861    
862 gezelter 2024 break;
863     case '?': /* Invalid option. */
864     /* `getopt_long' already printed an error message. */
865     goto failure;
866    
867     default: /* bug: option not considered. */
868     fprintf (stderr, "%s: option unknown: %c%s\n", CMDLINE_PARSER_PACKAGE, c, (additional_error ? additional_error : ""));
869     abort ();
870     } /* switch */
871     } /* while */
872    
873     if (args_info->sequentialProps_group_counter > 1)
874     {
875     fprintf (stderr, "%s: %d options of group sequentialProps were given. One is required%s.\n", argv[0], args_info->sequentialProps_group_counter, (additional_error ? additional_error : ""));
876     error = 1;
877     }
878    
879    
880    
881     if (check_required)
882     {
883     error += cmdline_parser_required2 (args_info, argv[0], additional_error);
884     }
885    
886     cmdline_parser_release (&local_args_info);
887    
888     if ( error )
889     return (EXIT_FAILURE);
890    
891     if (optind < argc)
892     {
893     int i = 0 ;
894     int found_prog_name = 0;
895     /* whether program name, i.e., argv[0], is in the remaining args
896     (this may happen with some implementations of getopt,
897     but surely not with the one included by gengetopt) */
898    
899     i = optind;
900     while (i < argc)
901     if (argv[i++] == argv[0]) {
902     found_prog_name = 1;
903     break;
904     }
905     i = 0;
906    
907     args_info->inputs_num = argc - optind - found_prog_name;
908     args_info->inputs =
909     (char **)(malloc ((args_info->inputs_num)*sizeof(char *))) ;
910     while (optind < argc)
911     if (argv[optind++] != argv[0])
912     args_info->inputs[ i++ ] = gengetopt_strdup (argv[optind-1]) ;
913     }
914    
915     return 0;
916    
917     failure:
918    
919     cmdline_parser_release (&local_args_info);
920     return (EXIT_FAILURE);
921     }

Properties

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