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root/OpenMD/branches/development/src/applications/staticProps/StaticPropsCmd.cpp
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Comparing branches/development/src/applications/staticProps/StaticPropsCmd.cpp (file contents):
Revision 1762 by plouden, Thu Jun 28 20:17:33 2012 UTC vs.
Revision 1848 by gezelter, Mon Feb 4 21:13:46 2013 UTC

# Line 1 | Line 1
1   /*
2    File autogenerated by gengetopt version 2.22.4
3    generated with the following command:
4 <  gengetopt -i StaticProps.ggo -c cpp -F StaticPropsCmd -u
4 >  gengetopt --file-name=StaticPropsCmd --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:
# Line 21 | Line 21
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 "StaticPropsCmd.h"
31  
# Line 52 | Line 56 | const char *gengetopt_args_info_help[] = {
56    "      --sele3=selection script  select the third stuntdouble set",
57    "      --refsele=selection script\n                                select reference (use and only use with --gxyz)",
58    "      --comsele=selection script\n                                select stunt doubles for center-of-mass \n                                  reference point",
59 +  "      --seleoffset=INT          global index offset for a second object (used \n                                  to define a vector between sites in molecule)",
60    "      --molname=STRING          molecule name",
61    "      --begin=INT               begin internal index",
62    "      --end=INT                 end internal index",
# Line 80 | Line 85 | const char *gengetopt_args_info_help[] = {
85    "      --angle_r                 angle of R",
86    "      --hullvol                 hull volume of nanoparticle",
87    "      --rodlength               length of nanorod",
88 <  "  -Q, --tet_param               tetrahedrality order parameter",
89 <  "      --tet_param_z             tetrahedrality order parameter by zbin(--sele1 \n                                  must be specified)",
88 >  "  -Q, --tet_param               tetrahedrality order parameter (Qk)",
89 >  "      --tet_param_z             spatially-resolved tetrahedrality order \n                                  parameter Qk(z)",
90      0
91   };
92  
# Line 129 | Line 134 | void clear_given (struct gengetopt_args_info *args_inf
134    args_info->sele3_given = 0 ;
135    args_info->refsele_given = 0 ;
136    args_info->comsele_given = 0 ;
137 +  args_info->seleoffset_given = 0 ;
138    args_info->molname_given = 0 ;
139    args_info->begin_given = 0 ;
140    args_info->end_given = 0 ;
# Line 197 | Line 203 | void clear_args (struct gengetopt_args_info *args_info
203    args_info->refsele_orig = NULL;
204    args_info->comsele_arg = NULL;
205    args_info->comsele_orig = NULL;
206 +  args_info->seleoffset_orig = NULL;
207    args_info->molname_arg = NULL;
208    args_info->molname_orig = NULL;
209    args_info->begin_orig = NULL;
# Line 230 | Line 237 | void init_args_info(struct gengetopt_args_info *args_i
237    args_info->sele3_help = gengetopt_args_info_help[17] ;
238    args_info->refsele_help = gengetopt_args_info_help[18] ;
239    args_info->comsele_help = gengetopt_args_info_help[19] ;
240 <  args_info->molname_help = gengetopt_args_info_help[20] ;
241 <  args_info->begin_help = gengetopt_args_info_help[21] ;
242 <  args_info->end_help = gengetopt_args_info_help[22] ;
243 <  args_info->radius_help = gengetopt_args_info_help[23] ;
244 <  args_info->bo_help = gengetopt_args_info_help[25] ;
245 <  args_info->bor_help = gengetopt_args_info_help[26] ;
246 <  args_info->bad_help = gengetopt_args_info_help[27] ;
247 <  args_info->count_help = gengetopt_args_info_help[28] ;
248 <  args_info->gofr_help = gengetopt_args_info_help[29] ;
249 <  args_info->gofz_help = gengetopt_args_info_help[30] ;
250 <  args_info->r_theta_help = gengetopt_args_info_help[31] ;
251 <  args_info->r_omega_help = gengetopt_args_info_help[32] ;
252 <  args_info->r_z_help = gengetopt_args_info_help[33] ;
253 <  args_info->theta_omega_help = gengetopt_args_info_help[34] ;
254 <  args_info->gxyz_help = gengetopt_args_info_help[35] ;
255 <  args_info->twodgofr_help = gengetopt_args_info_help[36] ;
256 <  args_info->p2_help = gengetopt_args_info_help[37] ;
257 <  args_info->rp2_help = gengetopt_args_info_help[38] ;
258 <  args_info->scd_help = gengetopt_args_info_help[39] ;
259 <  args_info->density_help = gengetopt_args_info_help[40] ;
260 <  args_info->slab_density_help = gengetopt_args_info_help[41] ;
261 <  args_info->p_angle_help = gengetopt_args_info_help[42] ;
262 <  args_info->hxy_help = gengetopt_args_info_help[43] ;
263 <  args_info->rho_r_help = gengetopt_args_info_help[44] ;
264 <  args_info->angle_r_help = gengetopt_args_info_help[45] ;
265 <  args_info->hullvol_help = gengetopt_args_info_help[46] ;
266 <  args_info->rodlength_help = gengetopt_args_info_help[47] ;
267 <  args_info->tet_param_help = gengetopt_args_info_help[48] ;
268 <  args_info->tet_param_z_help = gengetopt_args_info_help[49] ;
240 >  args_info->seleoffset_help = gengetopt_args_info_help[20] ;
241 >  args_info->molname_help = gengetopt_args_info_help[21] ;
242 >  args_info->begin_help = gengetopt_args_info_help[22] ;
243 >  args_info->end_help = gengetopt_args_info_help[23] ;
244 >  args_info->radius_help = gengetopt_args_info_help[24] ;
245 >  args_info->bo_help = gengetopt_args_info_help[26] ;
246 >  args_info->bor_help = gengetopt_args_info_help[27] ;
247 >  args_info->bad_help = gengetopt_args_info_help[28] ;
248 >  args_info->count_help = gengetopt_args_info_help[29] ;
249 >  args_info->gofr_help = gengetopt_args_info_help[30] ;
250 >  args_info->gofz_help = gengetopt_args_info_help[31] ;
251 >  args_info->r_theta_help = gengetopt_args_info_help[32] ;
252 >  args_info->r_omega_help = gengetopt_args_info_help[33] ;
253 >  args_info->r_z_help = gengetopt_args_info_help[34] ;
254 >  args_info->theta_omega_help = gengetopt_args_info_help[35] ;
255 >  args_info->gxyz_help = gengetopt_args_info_help[36] ;
256 >  args_info->twodgofr_help = gengetopt_args_info_help[37] ;
257 >  args_info->p2_help = gengetopt_args_info_help[38] ;
258 >  args_info->rp2_help = gengetopt_args_info_help[39] ;
259 >  args_info->scd_help = gengetopt_args_info_help[40] ;
260 >  args_info->density_help = gengetopt_args_info_help[41] ;
261 >  args_info->slab_density_help = gengetopt_args_info_help[42] ;
262 >  args_info->p_angle_help = gengetopt_args_info_help[43] ;
263 >  args_info->hxy_help = gengetopt_args_info_help[44] ;
264 >  args_info->rho_r_help = gengetopt_args_info_help[45] ;
265 >  args_info->angle_r_help = gengetopt_args_info_help[46] ;
266 >  args_info->hullvol_help = gengetopt_args_info_help[47] ;
267 >  args_info->rodlength_help = gengetopt_args_info_help[48] ;
268 >  args_info->tet_param_help = gengetopt_args_info_help[49] ;
269 >  args_info->tet_param_z_help = gengetopt_args_info_help[50] ;
270    
271   }
272  
# Line 367 | Line 375 | cmdline_parser_release (struct gengetopt_args_info *ar
375    free_string_field (&(args_info->refsele_orig));
376    free_string_field (&(args_info->comsele_arg));
377    free_string_field (&(args_info->comsele_orig));
378 +  free_string_field (&(args_info->seleoffset_orig));
379    free_string_field (&(args_info->molname_arg));
380    free_string_field (&(args_info->molname_orig));
381    free_string_field (&(args_info->begin_orig));
# Line 447 | Line 456 | cmdline_parser_dump(FILE *outfile, struct gengetopt_ar
456      write_into_file(outfile, "refsele", args_info->refsele_orig, 0);
457    if (args_info->comsele_given)
458      write_into_file(outfile, "comsele", args_info->comsele_orig, 0);
459 +  if (args_info->seleoffset_given)
460 +    write_into_file(outfile, "seleoffset", args_info->seleoffset_orig, 0);
461    if (args_info->molname_given)
462      write_into_file(outfile, "molname", args_info->molname_orig, 0);
463    if (args_info->begin_given)
# Line 848 | Line 859 | cmdline_parser_internal (
859          { "sele3",      1, NULL, 0 },
860          { "refsele",    1, NULL, 0 },
861          { "comsele",    1, NULL, 0 },
862 +        { "seleoffset", 1, NULL, 0 },
863          { "molname",    1, NULL, 0 },
864          { "begin",      1, NULL, 0 },
865          { "end",        1, NULL, 0 },
# Line 1064 | Line 1076 | cmdline_parser_internal (
1076              goto failure;
1077          
1078            break;
1079 <        case 'Q':       /* tetrahedrality order parameter.  */
1079 >        case 'Q':       /* tetrahedrality order parameter (Qk).  */
1080          
1081            if (args_info->staticProps_group_counter && override)
1082              reset_group_staticProps (args_info);
# Line 1203 | Line 1215 | cmdline_parser_internal (
1215                  &(local_args_info.comsele_given), optarg, 0, 0, ARG_STRING,
1216                  check_ambiguity, override, 0, 0,
1217                  "comsele", '-',
1218 +                additional_error))
1219 +              goto failure;
1220 +          
1221 +          }
1222 +          /* global index offset for a second object (used to define a vector between sites in molecule).  */
1223 +          else if (strcmp (long_options[option_index].name, "seleoffset") == 0)
1224 +          {
1225 +          
1226 +          
1227 +            if (update_arg( (void *)&(args_info->seleoffset_arg),
1228 +                 &(args_info->seleoffset_orig), &(args_info->seleoffset_given),
1229 +                &(local_args_info.seleoffset_given), optarg, 0, 0, ARG_INT,
1230 +                check_ambiguity, override, 0, 0,
1231 +                "seleoffset", '-',
1232                  additional_error))
1233                goto failure;
1234            
# Line 1586 | Line 1612 | cmdline_parser_internal (
1612                goto failure;
1613            
1614            }
1615 <          /* tetrahedrality order parameter by zbin(--sele1 must be specified).  */
1615 >          /* spatially-resolved tetrahedrality order parameter Qk(z).  */
1616            else if (strcmp (long_options[option_index].name, "tet_param_z") == 0)
1617            {
1618            

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