- Timestamp:
- Jul 3, 2017, 3:01:38 PM (7 years ago)
- Branches:
- Action_Thermostats, Add_SelectAtomByNameAction, Adding_Graph_to_ChangeBondActions, Adding_MD_integration_tests, Adding_StructOpt_integration_tests, AutomationFragmentation_failures, Candidate_v1.6.1, ChemicalSpaceEvaluator, EmpiricalPotential_contain_HomologyGraph_documentation, Enhance_userguide, Enhanced_StructuralOptimization, Enhanced_StructuralOptimization_continued, Example_ManyWaysToTranslateAtom, Exclude_Hydrogens_annealWithBondGraph, Fix_Verbose_Codepatterns, ForceAnnealing_oldresults, ForceAnnealing_with_BondGraph, ForceAnnealing_with_BondGraph_continued, ForceAnnealing_with_BondGraph_continued_betteresults, ForceAnnealing_with_BondGraph_contraction-expansion, Gui_displays_atomic_force_velocity, IndependentFragmentGrids_IntegrationTest, JobMarket_RobustOnKillsSegFaults, JobMarket_StableWorkerPool, PythonUI_with_named_parameters, Recreated_GuiChecks, StoppableMakroAction, TremoloParser_IncreasedPrecision, TremoloParser_MultipleTimesteps
- Children:
- 3f6aac
- Parents:
- f1cacb
- git-author:
- Frederik Heber <frederik.heber@…> (05/05/17 09:00:06)
- git-committer:
- Frederik Heber <frederik.heber@…> (07/03/17 15:01:38)
- File:
-
- 1 edited
Legend:
- Unmodified
- Added
- Removed
-
src/Actions/FragmentationAction/AnalyseFragmentationResultsAction.cpp
rf1cacb r9a4772 124 124 writeTable<MPQCDataEnergyMap_t, MPQCDataEnergyVector_noeigenvalues_t >()( 125 125 results.Result_Energy_fused, results.getMaxLevel()); 126 LOG(2, "DEBUG: Energy table is \n" << energyresult);126 LOG(2, "DEBUG: Energy table with cycles is \n" << energyresult); 127 127 std::string filename; 128 128 filename += FRAGMENTPREFIX + std::string("_CycleEnergy.dat"); … … 167 167 writeTable<MPQCDataEnergyMap_t, MPQCDataEnergyVector_noeigenvalues_t >()( 168 168 results.Result_Energy_fused, results.getMaxLevel()); 169 LOG( 2, "DEBUG: Energy table is \n" << energyresult);169 LOG(1, "DEBUG: Energy table is \n" << energyresult); 170 170 std::string filename; 171 171 filename += FRAGMENTPREFIX + std::string("_Energy.dat");
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