45 |
|
printf(" -z, --zconstraint replace the atom types of zconstraint \n molecules (default=off)\n"); |
46 |
|
printf(" -r, --rigidbody add a pseudo COM atom to rigidbody \n (default=off)\n"); |
47 |
|
printf(" -t, --watertype replace the atom type of water model \n (default=on)\n"); |
48 |
< |
printf(" -s, --selection=selection script general selection syntax(now only support \n select atoms within a specified range)\n"); |
48 |
> |
printf(" -s, --selection=selection script general selection syntax\n"); |
49 |
|
printf(" --originsele=selection script select origin\n"); |
50 |
|
printf(" --refsele=selection script select reference\n"); |
51 |
|
printf(" --repeatX=INT The number of images to repeat in the x \n direction (default=`0')\n"); |
244 |
|
args_info->watertype_flag = !(args_info->watertype_flag); |
245 |
|
break; |
246 |
|
|
247 |
< |
case 's': /* general selection syntax(now only support select atoms within a specified range). */ |
247 |
> |
case 's': /* general selection syntax. */ |
248 |
|
if (args_info->selection_given) |
249 |
|
{ |
250 |
|
fprintf (stderr, "%s: `--selection' (`-s') option given more than once\n", CMDLINE_PARSER_PACKAGE); |