# | Line 35 | Line 35 | cmdline_parser_print_help (void) | |
---|---|---|
35 | printf("\n" | |
36 | "Usage: %s [OPTIONS]...\n", CMDLINE_PARSER_PACKAGE); | |
37 | printf("\n"); | |
38 | < | printf(" -h, --help Print help and exit\n"); |
39 | < | printf(" -V, --version Print version and exit\n"); |
40 | < | printf(" -i, --input=filename input dump file\n"); |
41 | < | printf(" -o, --output=filename output file name\n"); |
42 | < | printf(" -n, --step=INT process every n frame (default=`1')\n"); |
43 | < | printf(" -r, --nrbins=INT number of bins for distance (default=`50')\n"); |
44 | < | printf(" -a, --nanglebins=INT number of bins for cos(angle) (default=`50')\n"); |
45 | < | printf(" -l, --length=DOUBLE maximum length (Defaults to 1/2 smallest length of first frame)\n"); |
46 | < | printf(" --sele1=selection script select first stuntdouble set\n"); |
47 | < | printf(" --sele2=selection script select second stuntdouble set\n"); |
38 | > | printf(" -h, --help Print help and exit\n"); |
39 | > | printf(" -V, --version Print version and exit\n"); |
40 | > | printf(" -i, --input=filename input dump file\n"); |
41 | > | printf(" -o, --output=filename output file name\n"); |
42 | > | printf(" -n, --step=INT process every n frame (default=`1')\n"); |
43 | > | printf(" -r, --nrbins=INT number of bins for distance (default=`100')\n"); |
44 | > | printf(" -a, --nanglebins=INT number of bins for cos(angle) (default=\n `50')\n"); |
45 | > | printf(" -l, --length=DOUBLE maximum length (Defaults to 1/2 smallest \n length of first frame)\n"); |
46 | > | printf(" --sele1=selection script select first stuntdouble set\n"); |
47 | > | printf(" --sele2=selection script select second stuntdouble set\n"); |
48 | > | printf(" --refsele=selection script select reference (use and only use with \n --gxyz)\n"); |
49 | printf("\n"); | |
50 | printf(" Group: staticProps an option of this group is required\n"); | |
51 | < | printf(" --gofr g(r)\n"); |
52 | < | printf(" --r_theta g(r, cos(theta))\n"); |
53 | < | printf(" --r_omega g(r, cos(omega))\n"); |
54 | < | printf(" --theta_omega g(cos(theta), cos(omega))\n"); |
55 | < | printf(" --xyz g(x, y, z)\n"); |
51 | > | printf(" --gofr g(r)\n"); |
52 | > | printf(" --r_theta g(r, cos(theta))\n"); |
53 | > | printf(" --r_omega g(r, cos(omega))\n"); |
54 | > | printf(" --theta_omega g(cos(theta), cos(omega))\n"); |
55 | > | printf(" --gxyz g(x, y, z)\n"); |
56 | } | |
57 | ||
58 | ||
# | Line 87 | Line 88 | cmdline_parser (int argc, char * const *argv, struct g | |
88 | args_info->length_given = 0 ; | |
89 | args_info->sele1_given = 0 ; | |
90 | args_info->sele2_given = 0 ; | |
91 | + | args_info->refsele_given = 0 ; |
92 | args_info->gofr_given = 0 ; | |
93 | args_info->r_theta_given = 0 ; | |
94 | args_info->r_omega_given = 0 ; | |
95 | args_info->theta_omega_given = 0 ; | |
96 | < | args_info->xyz_given = 0 ; |
96 | > | args_info->gxyz_given = 0 ; |
97 | #define clear_args() { \ | |
98 | args_info->input_arg = NULL; \ | |
99 | args_info->output_arg = NULL; \ | |
100 | args_info->step_arg = 1 ;\ | |
101 | < | args_info->nrbins_arg = 50 ;\ |
101 | > | args_info->nrbins_arg = 100 ;\ |
102 | args_info->nanglebins_arg = 50 ;\ | |
103 | args_info->sele1_arg = NULL; \ | |
104 | args_info->sele2_arg = NULL; \ | |
105 | + | args_info->refsele_arg = NULL; \ |
106 | } | |
107 | ||
108 | clear_args(); | |
# | Line 125 | Line 128 | cmdline_parser (int argc, char * const *argv, struct g | |
128 | { "length", 1, NULL, 'l' }, | |
129 | { "sele1", 1, NULL, 0 }, | |
130 | { "sele2", 1, NULL, 0 }, | |
131 | + | { "refsele", 1, NULL, 0 }, |
132 | { "gofr", 0, NULL, 0 }, | |
133 | { "r_theta", 0, NULL, 0 }, | |
134 | { "r_omega", 0, NULL, 0 }, | |
135 | { "theta_omega", 0, NULL, 0 }, | |
136 | < | { "xyz", 0, NULL, 0 }, |
136 | > | { "gxyz", 0, NULL, 0 }, |
137 | { NULL, 0, NULL, 0 } | |
138 | }; | |
139 | ||
# | Line 205 | Line 209 | cmdline_parser (int argc, char * const *argv, struct g | |
209 | args_info->nanglebins_arg = strtol (optarg,&stop_char,0); | |
210 | break; | |
211 | ||
212 | < | case 'l': /* maximum length (Defaults to cutoff radius). */ |
212 | > | case 'l': /* maximum length (Defaults to 1/2 smallest length of first frame). */ |
213 | if (args_info->length_given) | |
214 | { | |
215 | fprintf (stderr, "%s: `--length' (`-l') option given more than once\n", CMDLINE_PARSER_PACKAGE); | |
# | Line 243 | Line 247 | cmdline_parser (int argc, char * const *argv, struct g | |
247 | } | |
248 | args_info->sele2_given = 1; | |
249 | args_info->sele2_arg = gengetopt_strdup (optarg); | |
250 | + | break; |
251 | + | } |
252 | + | |
253 | + | /* select reference (use and only use with --gxyz). */ |
254 | + | else if (strcmp (long_options[option_index].name, "refsele") == 0) |
255 | + | { |
256 | + | if (args_info->refsele_given) |
257 | + | { |
258 | + | fprintf (stderr, "%s: `--refsele' option given more than once\n", CMDLINE_PARSER_PACKAGE); |
259 | + | clear_args (); |
260 | + | exit (EXIT_FAILURE); |
261 | + | } |
262 | + | args_info->refsele_given = 1; |
263 | + | args_info->refsele_arg = gengetopt_strdup (optarg); |
264 | break; | |
265 | } | |
266 | ||
# | Line 303 | Line 321 | cmdline_parser (int argc, char * const *argv, struct g | |
321 | } | |
322 | ||
323 | /* g(x, y, z). */ | |
324 | < | else if (strcmp (long_options[option_index].name, "xyz") == 0) |
324 | > | else if (strcmp (long_options[option_index].name, "gxyz") == 0) |
325 | { | |
326 | < | if (args_info->xyz_given) |
326 | > | if (args_info->gxyz_given) |
327 | { | |
328 | < | fprintf (stderr, "%s: `--xyz' option given more than once\n", CMDLINE_PARSER_PACKAGE); |
328 | > | fprintf (stderr, "%s: `--gxyz' option given more than once\n", CMDLINE_PARSER_PACKAGE); |
329 | clear_args (); | |
330 | exit (EXIT_FAILURE); | |
331 | } | |
332 | < | args_info->xyz_given = 1; staticProps_group_counter += 1; |
332 | > | args_info->gxyz_given = 1; staticProps_group_counter += 1; |
333 | ||
334 | break; | |
335 | } |
– | Removed lines |
+ | Added lines |
< | Changed lines |
> | Changed lines |