debug

[alexxy/gromacs-spacetimecorr.git] / src / spacetimecorr.cpp

diff --git a/src/spacetimecorr.cpp b/src/spacetimecorr.cpp
index 124e706cf976776a01a9c3ec79e744eb890a5918..39d375d1f4e0928f4aae3167dea2c48cfbe2188c 100644 (file)
--- a/src/spacetimecorr.cpp
+++ b/src/spacetimecorr.cpp
@@ -222,11 +222,13 @@ SpaceTimeCorr::initAfterFirstFrame(const TrajectoryAnalysisSettings &settings, c
 void
 SpaceTimeCorr::analyzeFrame(int frnr, const t_trxframe &fr, t_pbc *pbc, TrajectoryAnalysisModuleData *pdata)
 {
+    std::cout << "aF - start\n";
     trajectoryFrame.resize(0);
     trajectoryFrame.resize(index.size());
     for (size_t i {0}; i < index.size(); i++) {
         trajectoryFrame[i] = fr.x[index[i]];
     }
+    std::cout << "\tc.up - start\n";
     corrs.update(frnr, trajectoryFrame);
     std::cout << "\n\t\t" << frnr;
 }