source: src/Fragmentation/Summation/ValuePrinter.hpp@ e0ae58d

Action_Thermostats Add_AtomRandomPerturbation Add_FitFragmentPartialChargesAction Add_RotateAroundBondAction Add_SelectAtomByNameAction Added_ParseSaveFragmentResults AddingActions_SaveParseParticleParameters Adding_Graph_to_ChangeBondActions Adding_MD_integration_tests Adding_ParticleName_to_Atom Adding_StructOpt_integration_tests AtomFragments Automaking_mpqc_open AutomationFragmentation_failures Candidate_v1.5.4 Candidate_v1.6.0 Candidate_v1.6.1 ChangeBugEmailaddress ChangingTestPorts ChemicalSpaceEvaluator CombiningParticlePotentialParsing Combining_Subpackages Debian_Package_split Debian_package_split_molecuildergui_only Disabling_MemDebug Docu_Python_wait EmpiricalPotential_contain_HomologyGraph EmpiricalPotential_contain_HomologyGraph_documentation Enable_parallel_make_install Enhance_userguide Enhanced_StructuralOptimization Enhanced_StructuralOptimization_continued Example_ManyWaysToTranslateAtom Exclude_Hydrogens_annealWithBondGraph FitPartialCharges_GlobalError Fix_BoundInBox_CenterInBox_MoleculeActions Fix_ChargeSampling_PBC Fix_ChronosMutex Fix_FitPartialCharges Fix_FitPotential_needs_atomicnumbers Fix_ForceAnnealing Fix_IndependentFragmentGrids Fix_ParseParticles Fix_ParseParticles_split_forward_backward_Actions Fix_PopActions Fix_QtFragmentList_sorted_selection Fix_Restrictedkeyset_FragmentMolecule Fix_StatusMsg Fix_StepWorldTime_single_argument Fix_Verbose_Codepatterns Fix_fitting_potentials Fixes ForceAnnealing_goodresults ForceAnnealing_oldresults ForceAnnealing_tocheck ForceAnnealing_with_BondGraph ForceAnnealing_with_BondGraph_continued ForceAnnealing_with_BondGraph_continued_betteresults ForceAnnealing_with_BondGraph_contraction-expansion FragmentAction_writes_AtomFragments FragmentMolecule_checks_bonddegrees GeometryObjects Gui_Fixes Gui_displays_atomic_force_velocity ImplicitCharges IndependentFragmentGrids IndependentFragmentGrids_IndividualZeroInstances IndependentFragmentGrids_IntegrationTest IndependentFragmentGrids_Sole_NN_Calculation JobMarket_RobustOnKillsSegFaults JobMarket_StableWorkerPool JobMarket_unresolvable_hostname_fix MoreRobust_FragmentAutomation ODR_violation_mpqc_open PartialCharges_OrthogonalSummation PdbParser_setsAtomName PythonUI_with_named_parameters QtGui_reactivate_TimeChanged_changes Recreated_GuiChecks Rewrite_FitPartialCharges RotateToPrincipalAxisSystem_UndoRedo SaturateAtoms_findBestMatching SaturateAtoms_singleDegree StoppableMakroAction Subpackage_CodePatterns Subpackage_JobMarket Subpackage_LinearAlgebra Subpackage_levmar Subpackage_mpqc_open Subpackage_vmg Switchable_LogView ThirdParty_MPQC_rebuilt_buildsystem TrajectoryDependenant_MaxOrder TremoloParser_IncreasedPrecision TremoloParser_MultipleTimesteps TremoloParser_setsAtomName Ubuntu_1604_changes stable
Last change on this file since e0ae58d was 27afbf, checked in by Frederik Heber <heber@…>, 12 years ago

FragmentationAutomationAction now prints table of results for energy, force, and times.

  • added template functor writeTable that does what was present before as code in printReceivedMPQCResults().
  • Property mode set to 100644
File size: 1.3 KB
Line 
1/*
2 * ValuePrinter.hpp
3 *
4 * Created on: Aug 3, 2012
5 * Author: heber
6 */
7
8#ifndef VALUEPRINTER_HPP_
9#define VALUEPRINTER_HPP_
10
11
12// include config.h
13#ifdef HAVE_CONFIG_H
14#include <config.h>
15#endif
16
17#include <boost/fusion/container/map.hpp>
18#include <iomanip>
19#include <sstream>
20#include <string>
21
22#include "CodePatterns/toString.hpp"
23
24/** ValuePrinter prints the value for one row in a table of values each associated to a
25 * specific boost::fusion-style key \a MapKey.
26 *
27 * This is made such that we may use boost::mpl::for_each to quickly create
28 * the value line if specialized printName()s and a boost::fusion::vector
29 * containing all these keys is present
30 */
31template <typename MapType, int numprecision=5>
32struct ValuePrinter {
33 ValuePrinter(const MapType &_instance, const size_t level) :
34 instance(_instance),
35 value(toString(level))
36 {}
37
38 template <typename MapKey>
39 void operator()(MapKey &) {
40 //typedef typename boost::fusion::result_of::value_at_key<MapType, MapKey>::type MapValue;
41 std::stringstream valuestream;
42 valuestream << std::setprecision(numprecision) << boost::fusion::at_key<MapKey>(instance);
43 value += std::string("\t") + valuestream.str();
44 }
45
46 const std::string &get() const {
47 return value;
48 }
49
50private:
51 const MapType &instance;
52 std::string value;
53};
54
55
56#endif /* VALUEPRINTER_HPP_ */
Note: See TracBrowser for help on using the repository browser.