source: src/Fragmentation/Automation/FragmentJob.hpp@ dba6d1

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 dba6d1 was 7b22e9, checked in by Frederik Heber <heber@…>, 13 years ago

FragmentJob now contains Work() function.

  • also unit tests are now linked only against boost libs they really need.
  • Property mode set to 100644
File size: 1.5 KB
Line 
1/*
2 * FragmentJob.hpp
3 *
4 * Created on: Oct 19, 2011
5 * Author: heber
6 */
7
8#ifndef FRAGMENTJOB_HPP_
9#define FRAGMENTJOB_HPP_
10
11// include config.h
12#ifdef HAVE_CONFIG_H
13#include <config.h>
14#endif
15
16#include <string>
17
18#include "boost/serialization/array.hpp"
19
20#include "FragmentResult.hpp"
21#include "JobId.hpp"
22#include "types.hpp"
23
24class FragmentJobTest;
25class FragmentQueueTest;
26class FragmentWorker;
27
28/** FragmentJob contains all information for the Worker to start the job and
29 * deliver a FragmentResult.
30 *
31 * Important is that this class is fully serializable such that it can be
32 * transfered to a scheduler (server) and be deserialized by the Worker.
33 */
34class FragmentJob : public JobId
35{
36 //!> allow FragmentQueue unit test access
37 friend class FragmentQueueTest;
38 //!> allow own unit test access
39 friend class FragmentJobTest;
40public:
41 FragmentJob();
42 FragmentJob(const std::string &_outputfile, const JobId_t _JobId);
43 ~FragmentJob();
44
45 FragmentResult Work();
46
47 bool operator==(const FragmentJob &other) const;
48
49 bool operator!=(const FragmentJob &other) const {
50 return !(*this == other);
51 }
52
53 //!> string containing the configuration file for the solver
54 std::string outputfile;
55
56private:
57 friend class boost::serialization::access;
58 // serialization
59 template <typename Archive>
60 void serialize(Archive& ar, const unsigned int version)
61 {
62 ar & boost::serialization::base_object<JobId>(*this);
63 ar & outputfile;
64 }
65};
66
67
68#endif /* FRAGMENTJOB_HPP_ */
Note: See TracBrowser for help on using the repository browser.