130 |
|
rdf = new GofROmega(info, dumpFileName, sele1, sele2, maxLen, args_info.nrbins_arg, args_info.nanglebins_arg); |
131 |
|
} else if (args_info.theta_omega_given) { |
132 |
|
rdf = new GofAngle2(info, dumpFileName, sele1, sele2, args_info.nanglebins_arg); |
133 |
< |
} else if (args_info.xyz_given) { |
134 |
< |
rdf= new GofXyz(info, dumpFileName, sele1, sele2, maxLen, args_info.nrbins_arg); |
133 |
> |
} else if (args_info.gxyz_given) { |
134 |
> |
if (args_info.refsele_given) { |
135 |
> |
rdf= new GofXyz(info, dumpFileName, sele1, sele2,args_info.refsele_arg, maxLen, args_info.nrbins_arg); |
136 |
> |
} else { |
137 |
> |
sprintf( painCave.errMsg, |
138 |
> |
"--refsele must set when --gxyz is used"); |
139 |
> |
painCave.severity = OOPSE_ERROR; |
140 |
> |
painCave.isFatal = 1; |
141 |
> |
simError(); |
142 |
> |
} |
143 |
|
} |
144 |
|
|
145 |
|
if (args_info.output_given) { |