Changeset ef59aa for src/Dynamics

Timestamp:

Aug 2, 2017, 8:26:47 PM (8 years ago)

Author:

Frederik Heber <frederik.heber@…>

Branches:

ForceAnnealing_with_BondGraph_continued

Children:

ac79b2

Parents:

c4a725

Message:

tempcommit: CurrentStep was wrongly calculated.

File:

• src/Dynamics/ForceAnnealing.hpp (modified) (1 diff)

src/Dynamics/ForceAnnealing.hpp

@@ -317 +317 @@
       // TODO: We have this extra step in between because of DoOutput copying
       // change this making the code easier to understand
-      const size_t CurrentStep = CurrentTimeStep-2*timestep >= 0 ? CurrentTimeStep - 2*timestep : 0;
+      const size_t CurrentStep = CurrentTimeStep-timestep >= 0 ? CurrentTimeStep - timestep : 0;
+      LOG(2, "DEBUG: CurrentTimeStep is " << CurrentTimeStep
+          << ", timestep is " << timestep
+          << ", and CurrentStep is " << CurrentStep);
 
       for(typename AtomSetMixin<T>::const_iterator iter = AtomicForceManipulator<T>::atoms.begin();