- debug

diff --git a/src/colorvec.cpp b/src/colorvec.cpp
index 8ba04bbe2895e7b3b3dc7dc37ca1d894a1df91c6..8e7848f7a1fa291b23578d62e6dce55fba8115e0 100644 (file)
--- a/src/colorvec.cpp
+++ b/src/colorvec.cpp
@@ -196,9 +196,9 @@ bool isNearPeptide(const t_trxframe &fr, const t_pbc *pbc, const std::vector< gm
                           gmx::AnalysisNeighborhood &nbhood, const std::vector< size_t > &inputIndex,
                           const std::vector< std::pair< std::string, size_t > > &inputColor) {
     gmx::AnalysisNeighborhoodSearch     nbsearch = nbhood.initSearch(pbc, gmx::AnalysisNeighborhoodPositions(fr.x, fr.natoms));
-    gmx::AnalysisNeighborhoodPair       pair;
     for (const auto &i : inputColor) {
         gmx::AnalysisNeighborhoodPairSearch pairSearch = nbsearch.startPairSearch(inputFrame[i.second].as_vec());
+        gmx::AnalysisNeighborhoodPair       pair;
         std::cout << std::endl << i.first << std::endl;
         int count1 {0};
         while (pairSearch.findNextPair(&pair)) {