233 |
|
simError(); |
234 |
|
} |
235 |
|
} else if (args_info.p2_given) { |
236 |
< |
analyser = new P2OrderParameter(info, dumpFileName, sele1, sele2); |
236 |
> |
if (args_info.sele1_given) { |
237 |
> |
if (args_info.sele2_given) |
238 |
> |
analyser = new P2OrderParameter(info, dumpFileName, sele1, sele2); |
239 |
> |
else |
240 |
> |
analyser = new P2OrderParameter(info, dumpFileName, sele1); |
241 |
> |
} else { |
242 |
> |
sprintf( painCave.errMsg, |
243 |
> |
"At least one selection script (--sele1) must be specified when calculating P2 order parameters"); |
244 |
> |
painCave.severity = OPENMD_ERROR; |
245 |
> |
painCave.isFatal = 1; |
246 |
> |
simError(); |
247 |
> |
} |
248 |
|
} else if (args_info.rp2_given){ |
249 |
|
analyser = new RippleOP(info, dumpFileName, sele1, sele2); |
250 |
|
} else if (args_info.bo_given){ |