update compute descriptors

src/ML-POD/fitpod_command.cpp

@@ -73,8 +73,6 @@ void FitPOD::command(int narg, char **arg)
 
   if (coeff_file != "") podArrayCopy(desc.c, fastpodptr->coeff, fastpodptr->nCoeffAll);
 
-  if (compute_descriptors==0) {
-
   if (((int) envdata.data_path.size() > 1) && (desc.nClusters > 1)) {
     environment_cluster_calculation(envdata);
     //error->all(FLERR, "stop after environment_cluster_calculation");
@@ -88,6 +86,8 @@ void FitPOD::command(int narg, char **arg)
       memory->destroy(envdata.wf);
   }
   
+  if (compute_descriptors==0) {
+
     // compute POD coefficients using least-squares method
     if (coeff_file == "") {
       least_squares_fit(traindata);