Changeset daf5d6 for molecuilder/src/molecules.cpp

Timestamp:

Aug 19, 2009, 12:30:21 PM (16 years ago)

Author:

Frederik Heber <heber@…>

Children:

78dac6

Parents:

27459a (diff), 6c09a4 (diff)
Note: this is a merge changeset, the changes displayed below correspond to the merge itself.
Use the (diff) links above to see all the changes relative to each parent.

Message:

Merge branch 'VectorUnitTest' into ConcaveHull

File:

• molecuilder/src/molecules.cpp (modified) (1 diff)

molecuilder/src/molecules.cpp

@@ -7 +7 @@
 #include "config.hpp"
 #include "molecules.hpp"
-
-/************************************* Other Functions *************************************/
-
-/** Determines sum of squared distances of \a X to all \a **vectors.
- * \param *x reference vector
- * \param *params
- * \return sum of square distances
- */
-double LSQ (const gsl_vector * x, void * params)
-{
-  double sum = 0.;
-  struct LSQ_params *par = (struct LSQ_params *)params;
-  Vector **vectors = par->vectors;
-  int num = par->num;
-
-  for (int i=num;i--;) {
-    for(int j=NDIM;j--;)
-      sum += (gsl_vector_get(x,j) - (vectors[i])->x[j])*(gsl_vector_get(x,j) - (vectors[i])->x[j]);
-  }
-
-  return sum;
-};
 
 /************************************* Functions for class molecule *********************************/