Changeset 33af20 for src/Parser/TremoloParser.hpp

Timestamp:

Jul 12, 2017, 7:10:07 PM (7 years ago)

Author:

Frederik Heber <frederik.heber@…>

Branches:

Action_Thermostats, Adding_Graph_to_ChangeBondActions, Adding_MD_integration_tests, Adding_StructOpt_integration_tests, AutomationFragmentation_failures, Candidate_v1.6.1, ChemicalSpaceEvaluator, Enhanced_StructuralOptimization, Enhanced_StructuralOptimization_continued, Example_ManyWaysToTranslateAtom, Exclude_Hydrogens_annealWithBondGraph, Fix_Verbose_Codepatterns, ForceAnnealing_with_BondGraph, ForceAnnealing_with_BondGraph_continued, ForceAnnealing_with_BondGraph_continued_betteresults, ForceAnnealing_with_BondGraph_contraction-expansion, Gui_displays_atomic_force_velocity, JobMarket_RobustOnKillsSegFaults, JobMarket_StableWorkerPool, PythonUI_with_named_parameters, Recreated_GuiChecks, StoppableMakroAction, TremoloParser_IncreasedPrecision, TremoloParser_MultipleTimesteps

Children:

70f2a1

Parents:

0e894a

git-author:

Frederik Heber <frederik.heber@…> (06/17/17 23:09:44)

git-committer:

Frederik Heber <frederik.heber@…> (07/12/17 19:10:07)

Message:

TremoloParser::save() now supports multiple time steps.

• TESTS: Removed XFAIL from tests Tremolo with multiple time steps.

File:

• src/Parser/TremoloParser.hpp (modified) (1 diff)

src/Parser/TremoloParser.hpp

@@ -94 +94 @@
   bool isUsedField(const usedFields_t &fields, const std::string &fieldName) const;
   void writeNeighbors(std::ostream* file, const int numberOfNeighbors, const atom* const currentAtom);
-  void saveLine(std::ostream* file, const atom* const currentAtom);
+  void saveLine(
+      std::ostream* file,
+      const atom* const currentAtom,
+      const size_t _timestep);
   void save_AtomDataLine(std::ostream* file) const;
   void save_BoxLine(std::ostream* file) const;