trunk/SHAPES/forcerCmd.c

/*
  File autogenerated by gengetopt version 2.12.1
  generated with the following command:
  gengetopt --file-name=forcerCmd 

  The developers of gengetopt consider the fixed text that goes in all
  gengetopt output files to be in the public domain:
  we make no copyright claims on it.
*/

/* If we use autoconf.  */
#ifdef HAVE_CONFIG_H
#include "config.h"
#endif

#include <stdio.h>
#include <stdlib.h>
#include <string.h>

#include "getopt.h"

#include "forcerCmd.h"

static
void clear_given (struct gengetopt_args_info *args_info);
static
void clear_args (struct gengetopt_args_info *args_info);

static int
cmdline_parser_internal (int argc, char * const *argv, struct gengetopt_args_info *args_info, int override, int initialize, int check_required, const char *additional_error);

static char *
gengetopt_strdup (const char *s);

static
void clear_given (struct gengetopt_args_info *args_info)
{
  args_info->help_given = 0 ;
  args_info->version_given = 0 ;
  args_info->input_given = 0 ;
  args_info->charmm_given = 0 ;
  args_info->amber_given = 0 ;
  args_info->lj_given = 0 ;
  args_info->gaff_given = 0 ;
  args_info->opls_given = 0 ;
  args_info->ForceField_group_counter = 0 ;
}

static
void clear_args (struct gengetopt_args_info *args_info)
{
  args_info->input_arg = NULL;
}

void
cmdline_parser_print_version (void)
{
  printf ("%s %s\n", CMDLINE_PARSER_PACKAGE, CMDLINE_PARSER_VERSION);
}

void
cmdline_parser_print_help (void)
{
  cmdline_parser_print_version ();
  printf("\n"
  "Usage: %s [OPTIONS]...\n", CMDLINE_PARSER_PACKAGE);
  printf("\n");
  printf("%s\n","  -h, --help            Print help and exit");
  printf("%s\n","  -V, --version         Print version and exit");
  printf("%s\n","  -i, --input=filename  input file name");
  printf("\n");
  printf(" Group: ForceField A Force Field must be specified\n");
  printf("%s\n","  -c, --charmm          Use CHARMM 27 parameters");
  printf("%s\n","  -a, --amber           Use Amber99 parameters");
  printf("%s\n","  -l, --lj              Use Lennard-Jones parameters");
  printf("%s\n","  -g, --gaff            Use GAFF parameters");
  printf("%s\n","  -o, --opls            Use OPLS/AA parameters");
}

void
cmdline_parser_init (struct gengetopt_args_info *args_info)
{
  clear_given (args_info);
  clear_args (args_info);
}

void
cmdline_parser_free (struct gengetopt_args_info *args_info)
{
  
  if (args_info->input_arg)
    {
      free (args_info->input_arg); /* free previous argument */
      args_info->input_arg = 0;
    }
  
  clear_given (args_info);
}


/* gengetopt_strdup() */
/* strdup.c replacement of strdup, which is not standard */
char *
gengetopt_strdup (const char *s)
{
  char *result = NULL;
  if (!s)
    return result;

  result = (char*)malloc(strlen(s) + 1);
  if (result == (char*)0)
    return (char*)0;
  strcpy(result, s);
  return result;
}

static void
reset_group_ForceField(struct gengetopt_args_info *args_info);

static void
reset_group_ForceField(struct gengetopt_args_info *args_info)
{
  if (! args_info->ForceField_group_counter)
    return;
  
  args_info->charmm_given = 0 ;
  args_info->amber_given = 0 ;
  args_info->lj_given = 0 ;
  args_info->gaff_given = 0 ;
  args_info->opls_given = 0 ;

  args_info->ForceField_group_counter = 0;
}

int
cmdline_parser (int argc, char * const *argv, struct gengetopt_args_info *args_info)
{
  return cmdline_parser2 (argc, argv, args_info, 0, 1, 1);
}

int
cmdline_parser2 (int argc, char * const *argv, struct gengetopt_args_info *args_info, int override, int initialize, int check_required)
{
  int result;
  
  result = cmdline_parser_internal (argc, argv, args_info, override, initialize, check_required, NULL);
  
  if (result == EXIT_FAILURE)
    {
      cmdline_parser_free (args_info);
      exit (EXIT_FAILURE);
    }
  
  return result;
}

int
cmdline_parser_internal (int argc, char * const *argv, struct gengetopt_args_info *args_info, int override, int initialize, int check_required, const char *additional_error)
{
  int c;        /* Character of the parsed option.  */
  int error = 0;
  struct gengetopt_args_info local_args_info;

  if (initialize)
    cmdline_parser_init (args_info);

  cmdline_parser_init (&local_args_info);

  optarg = 0;
  optind = 1;
  opterr = 1;
  optopt = '?';

  while (1)
    {
      int option_index = 0;
      char *stop_char;

      static struct option long_options[] = {
        { "help",       0, NULL, 'h' },
        { "version",    0, NULL, 'V' },
        { "input",      1, NULL, 'i' },
        { "charmm",     0, NULL, 'c' },
        { "amber",      0, NULL, 'a' },
        { "lj", 0, NULL, 'l' },
        { "gaff",       0, NULL, 'g' },
        { "opls",       0, NULL, 'o' },
        { NULL, 0, NULL, 0 }
      };

      stop_char = 0;
      c = getopt_long (argc, argv, "hVi:calgo", long_options, &option_index);

      if (c == -1) break;       /* Exit from `while (1)' loop.  */

      switch (c)
        {
        case 'h':       /* Print help and exit.  */
          cmdline_parser_print_help ();
          exit (EXIT_SUCCESS);

        case 'V':       /* Print version and exit.  */
          cmdline_parser_print_version ();
          exit (EXIT_SUCCESS);

        case 'i':       /* input file name.  */
          if (local_args_info.input_given)
            {
              fprintf (stderr, "%s: `--input' (`-i') option given more than once%s\n", CMDLINE_PARSER_PACKAGE, (additional_error ? additional_error : ""));
              goto failure;
            }
          if (args_info->input_given && ! override)
            continue;
          local_args_info.input_given = 1;
          args_info->input_given = 1;
          if (args_info->input_arg)
            free (args_info->input_arg); /* free previous string */
          args_info->input_arg = gengetopt_strdup (optarg);
          break;

        case 'c':       /* Use CHARMM 27 parameters.  */
          if (local_args_info.charmm_given)
            {
              fprintf (stderr, "%s: `--charmm' (`-c') option given more than once%s\n", CMDLINE_PARSER_PACKAGE, (additional_error ? additional_error : ""));
              goto failure;
            }
          if (args_info->charmm_given && ! override)
            continue;
          local_args_info.charmm_given = 1;
          args_info->charmm_given = 1;
          if (args_info->ForceField_group_counter && override)
            reset_group_ForceField (args_info);
          args_info->ForceField_group_counter += 1;
          break;

        case 'a':       /* Use Amber99 parameters.  */
          if (local_args_info.amber_given)
            {
              fprintf (stderr, "%s: `--amber' (`-a') option given more than once%s\n", CMDLINE_PARSER_PACKAGE, (additional_error ? additional_error : ""));
              goto failure;
            }
          if (args_info->amber_given && ! override)
            continue;
          local_args_info.amber_given = 1;
          args_info->amber_given = 1;
          if (args_info->ForceField_group_counter && override)
            reset_group_ForceField (args_info);
          args_info->ForceField_group_counter += 1;
          break;

        case 'l':       /* Use Lennard-Jones parameters.  */
          if (local_args_info.lj_given)
            {
              fprintf (stderr, "%s: `--lj' (`-l') option given more than once%s\n", CMDLINE_PARSER_PACKAGE, (additional_error ? additional_error : ""));
              goto failure;
            }
          if (args_info->lj_given && ! override)
            continue;
          local_args_info.lj_given = 1;
          args_info->lj_given = 1;
          if (args_info->ForceField_group_counter && override)
            reset_group_ForceField (args_info);
          args_info->ForceField_group_counter += 1;
          break;

        case 'g':       /* Use GAFF parameters.  */
          if (local_args_info.gaff_given)
            {
              fprintf (stderr, "%s: `--gaff' (`-g') option given more than once%s\n", CMDLINE_PARSER_PACKAGE, (additional_error ? additional_error : ""));
              goto failure;
            }
          if (args_info->gaff_given && ! override)
            continue;
          local_args_info.gaff_given = 1;
          args_info->gaff_given = 1;
          if (args_info->ForceField_group_counter && override)
            reset_group_ForceField (args_info);
          args_info->ForceField_group_counter += 1;
          break;

        case 'o':       /* Use OPLS/AA parameters.  */
          if (local_args_info.opls_given)
            {
              fprintf (stderr, "%s: `--opls' (`-o') option given more than once%s\n", CMDLINE_PARSER_PACKAGE, (additional_error ? additional_error : ""));
              goto failure;
            }
          if (args_info->opls_given && ! override)
            continue;
          local_args_info.opls_given = 1;
          args_info->opls_given = 1;
          if (args_info->ForceField_group_counter && override)
            reset_group_ForceField (args_info);
          args_info->ForceField_group_counter += 1;
          break;


        case 0: /* Long option with no short option */

        case '?':       /* Invalid option.  */
          /* `getopt_long' already printed an error message.  */
          goto failure;

        default:        /* bug: option not considered.  */
          fprintf (stderr, "%s: option unknown: %c%s\n", CMDLINE_PARSER_PACKAGE, c, (additional_error ? additional_error : ""));
          abort ();
        } /* switch */
    } /* while */

  if ( args_info->ForceField_group_counter != 1)
    {
      fprintf (stderr, "%s: %d options of group ForceField were given. One is required.%s\n", CMDLINE_PARSER_PACKAGE, args_info->ForceField_group_counter, (additional_error ? additional_error : ""));
      error = 1;
    }
  

  if (check_required)
    {
      if (! args_info->input_given)
        {
          fprintf (stderr, "%s: '--input' ('-i') option required%s\n", CMDLINE_PARSER_PACKAGE, (additional_error ? additional_error : ""));
          error = 1;
        }
    }

  if ( error )
    return (EXIT_FAILURE);

  return 0;

failure:
  cmdline_parser_free (&local_args_info);
  return (EXIT_FAILURE);
}
Revision:	1240
Committed:	Fri Jun 4 16:11:27 2004 UTC (20 years, 1 month ago) by gezelter
Content type:	text/plain
File size:	10053 byte(s)
Log Message:	Initial import of SHAPES code
#	User	Rev	Content
1	gezelter	1240	/*
2			File autogenerated by gengetopt version 2.12.1
3			generated with the following command:
4			gengetopt --file-name=forcerCmd
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			#include "getopt.h"
21
22			#include "forcerCmd.h"
23
24			static
25			void clear_given (struct gengetopt_args_info *args_info);
26			static
27			void clear_args (struct gengetopt_args_info *args_info);
28
29			static int
30			cmdline_parser_internal (int argc, char * const argv, struct gengetopt_args_info args_info, int override, int initialize, int check_required, const char *additional_error);
31
32			static char *
33			gengetopt_strdup (const char *s);
34
35			static
36			void clear_given (struct gengetopt_args_info *args_info)
37			{
38			args_info->help_given = 0 ;
39			args_info->version_given = 0 ;
40			args_info->input_given = 0 ;
41			args_info->charmm_given = 0 ;
42			args_info->amber_given = 0 ;
43			args_info->lj_given = 0 ;
44			args_info->gaff_given = 0 ;
45			args_info->opls_given = 0 ;
46			args_info->ForceField_group_counter = 0 ;
47			}
48
49			static
50			void clear_args (struct gengetopt_args_info *args_info)
51			{
52			args_info->input_arg = NULL;
53			}
54
55			void
56			cmdline_parser_print_version (void)
57			{
58			printf ("%s %s\n", CMDLINE_PARSER_PACKAGE, CMDLINE_PARSER_VERSION);
59			}
60
61			void
62			cmdline_parser_print_help (void)
63			{
64			cmdline_parser_print_version ();
65			printf("\n"
66			"Usage: %s [OPTIONS]...\n", CMDLINE_PARSER_PACKAGE);
67			printf("\n");
68			printf("%s\n"," -h, --help Print help and exit");
69			printf("%s\n"," -V, --version Print version and exit");
70			printf("%s\n"," -i, --input=filename input file name");
71			printf("\n");
72			printf(" Group: ForceField A Force Field must be specified\n");
73			printf("%s\n"," -c, --charmm Use CHARMM 27 parameters");
74			printf("%s\n"," -a, --amber Use Amber99 parameters");
75			printf("%s\n"," -l, --lj Use Lennard-Jones parameters");
76			printf("%s\n"," -g, --gaff Use GAFF parameters");
77			printf("%s\n"," -o, --opls Use OPLS/AA parameters");
78			}
79
80			void
81			cmdline_parser_init (struct gengetopt_args_info *args_info)
82			{
83			clear_given (args_info);
84			clear_args (args_info);
85			}
86
87			void
88			cmdline_parser_free (struct gengetopt_args_info *args_info)
89			{
90
91			if (args_info->input_arg)
92			{
93			free (args_info->input_arg); /* free previous argument */
94			args_info->input_arg = 0;
95			}
96
97			clear_given (args_info);
98			}
99
100
101			/* gengetopt_strdup() */
102			/* strdup.c replacement of strdup, which is not standard */
103			char *
104			gengetopt_strdup (const char *s)
105			{
106			char *result = NULL;
107			if (!s)
108			return result;
109
110			result = (char*)malloc(strlen(s) + 1);
111			if (result == (char*)0)
112			return (char*)0;
113			strcpy(result, s);
114			return result;
115			}
116
117			static void
118			reset_group_ForceField(struct gengetopt_args_info *args_info);
119
120			static void
121			reset_group_ForceField(struct gengetopt_args_info *args_info)
122			{
123			if (! args_info->ForceField_group_counter)
124			return;
125
126			args_info->charmm_given = 0 ;
127			args_info->amber_given = 0 ;
128			args_info->lj_given = 0 ;
129			args_info->gaff_given = 0 ;
130			args_info->opls_given = 0 ;
131
132			args_info->ForceField_group_counter = 0;
133			}
134
135			int
136			cmdline_parser (int argc, char * const argv, struct gengetopt_args_info args_info)
137			{
138			return cmdline_parser2 (argc, argv, args_info, 0, 1, 1);
139			}
140
141			int
142			cmdline_parser2 (int argc, char * const argv, struct gengetopt_args_info args_info, int override, int initialize, int check_required)
143			{
144			int result;
145
146			result = cmdline_parser_internal (argc, argv, args_info, override, initialize, check_required, NULL);
147
148			if (result == EXIT_FAILURE)
149			{
150			cmdline_parser_free (args_info);
151			exit (EXIT_FAILURE);
152			}
153
154			return result;
155			}
156
157			int
158			cmdline_parser_internal (int argc, char * const argv, struct gengetopt_args_info args_info, int override, int initialize, int check_required, const char *additional_error)
159			{
160			int c; /* Character of the parsed option. */
161			int error = 0;
162			struct gengetopt_args_info local_args_info;
163
164			if (initialize)
165			cmdline_parser_init (args_info);
166
167			cmdline_parser_init (&local_args_info);
168
169			optarg = 0;
170			optind = 1;
171			opterr = 1;
172			optopt = '?';
173
174			while (1)
175			{
176			int option_index = 0;
177			char *stop_char;
178
179			static struct option long_options[] = {
180			{ "help", 0, NULL, 'h' },
181			{ "version", 0, NULL, 'V' },
182			{ "input", 1, NULL, 'i' },
183			{ "charmm", 0, NULL, 'c' },
184			{ "amber", 0, NULL, 'a' },
185			{ "lj", 0, NULL, 'l' },
186			{ "gaff", 0, NULL, 'g' },
187			{ "opls", 0, NULL, 'o' },
188			{ NULL, 0, NULL, 0 }
189			};
190
191			stop_char = 0;
192			c = getopt_long (argc, argv, "hVi:calgo", long_options, &option_index);
193
194			if (c == -1) break; /* Exit from `while (1)' loop. */
195
196			switch (c)
197			{
198			case 'h': /* Print help and exit. */
199			cmdline_parser_print_help ();
200			exit (EXIT_SUCCESS);
201
202			case 'V': /* Print version and exit. */
203			cmdline_parser_print_version ();
204			exit (EXIT_SUCCESS);
205
206			case 'i': /* input file name. */
207			if (local_args_info.input_given)
208			{
209			fprintf (stderr, "%s: `--input' (`-i') option given more than once%s\n", CMDLINE_PARSER_PACKAGE, (additional_error ? additional_error : ""));
210			goto failure;
211			}
212			if (args_info->input_given && ! override)
213			continue;
214			local_args_info.input_given = 1;
215			args_info->input_given = 1;
216			if (args_info->input_arg)
217			free (args_info->input_arg); /* free previous string */
218			args_info->input_arg = gengetopt_strdup (optarg);
219			break;
220
221			case 'c': /* Use CHARMM 27 parameters. */
222			if (local_args_info.charmm_given)
223			{
224			fprintf (stderr, "%s: `--charmm' (`-c') option given more than once%s\n", CMDLINE_PARSER_PACKAGE, (additional_error ? additional_error : ""));
225			goto failure;
226			}
227			if (args_info->charmm_given && ! override)
228			continue;
229			local_args_info.charmm_given = 1;
230			args_info->charmm_given = 1;
231			if (args_info->ForceField_group_counter && override)
232			reset_group_ForceField (args_info);
233			args_info->ForceField_group_counter += 1;
234			break;
235
236			case 'a': /* Use Amber99 parameters. */
237			if (local_args_info.amber_given)
238			{
239			fprintf (stderr, "%s: `--amber' (`-a') option given more than once%s\n", CMDLINE_PARSER_PACKAGE, (additional_error ? additional_error : ""));
240			goto failure;
241			}
242			if (args_info->amber_given && ! override)
243			continue;
244			local_args_info.amber_given = 1;
245			args_info->amber_given = 1;
246			if (args_info->ForceField_group_counter && override)
247			reset_group_ForceField (args_info);
248			args_info->ForceField_group_counter += 1;
249			break;
250
251			case 'l': /* Use Lennard-Jones parameters. */
252			if (local_args_info.lj_given)
253			{
254			fprintf (stderr, "%s: `--lj' (`-l') option given more than once%s\n", CMDLINE_PARSER_PACKAGE, (additional_error ? additional_error : ""));
255			goto failure;
256			}
257			if (args_info->lj_given && ! override)
258			continue;
259			local_args_info.lj_given = 1;
260			args_info->lj_given = 1;
261			if (args_info->ForceField_group_counter && override)
262			reset_group_ForceField (args_info);
263			args_info->ForceField_group_counter += 1;
264			break;
265
266			case 'g': /* Use GAFF parameters. */
267			if (local_args_info.gaff_given)
268			{
269			fprintf (stderr, "%s: `--gaff' (`-g') option given more than once%s\n", CMDLINE_PARSER_PACKAGE, (additional_error ? additional_error : ""));
270			goto failure;
271			}
272			if (args_info->gaff_given && ! override)
273			continue;
274			local_args_info.gaff_given = 1;
275			args_info->gaff_given = 1;
276			if (args_info->ForceField_group_counter && override)
277			reset_group_ForceField (args_info);
278			args_info->ForceField_group_counter += 1;
279			break;
280
281			case 'o': /* Use OPLS/AA parameters. */
282			if (local_args_info.opls_given)
283			{
284			fprintf (stderr, "%s: `--opls' (`-o') option given more than once%s\n", CMDLINE_PARSER_PACKAGE, (additional_error ? additional_error : ""));
285			goto failure;
286			}
287			if (args_info->opls_given && ! override)
288			continue;
289			local_args_info.opls_given = 1;
290			args_info->opls_given = 1;
291			if (args_info->ForceField_group_counter && override)
292			reset_group_ForceField (args_info);
293			args_info->ForceField_group_counter += 1;
294			break;
295
296
297			case 0: /* Long option with no short option */
298
299			case '?': /* Invalid option. */
300			/* `getopt_long' already printed an error message. */
301			goto failure;
302
303			default: /* bug: option not considered. */
304			fprintf (stderr, "%s: option unknown: %c%s\n", CMDLINE_PARSER_PACKAGE, c, (additional_error ? additional_error : ""));
305			abort ();
306			} /* switch */
307			} /* while */
308
309			if ( args_info->ForceField_group_counter != 1)
310			{
311			fprintf (stderr, "%s: %d options of group ForceField were given. One is required.%s\n", CMDLINE_PARSER_PACKAGE, args_info->ForceField_group_counter, (additional_error ? additional_error : ""));
312			error = 1;
313			}
314
315
316
317			if (check_required)
318			{
319			if (! args_info->input_given)
320			{
321			fprintf (stderr, "%s: '--input' ('-i') option required%s\n", CMDLINE_PARSER_PACKAGE, (additional_error ? additional_error : ""));
322			error = 1;
323			}
324			}
325
326			if ( error )
327			return (EXIT_FAILURE);
328
329			return 0;
330
331			failure:
332			cmdline_parser_free (&local_args_info);
333			return (EXIT_FAILURE);
334			}