source: src/Fragmentation/Automation/Worker.cpp@ 17017b

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 17017b was d920b9, checked in by Frederik Heber <heber@…>, 13 years ago

Abstracted FragmentJob and introduced SystemCommandJob which has its former functionality.

  • FragmentJob now has just virtual function Work(), not implemented.
  • former command and outputfile is taken over by SystemCommandJob.
  • a FragmentJob or derived class is default cstor'ed always with JobId::IllegalJob.
  • so far SystemCommandJob captures command's stdout and parses it back from file. We use mkstemps() for creating a random file and popen() to pipe stdout directly. For this we require boost::iostreams and ::filesystem.
  • SystemCommandJob has virtual method extractString() to be adaptable to the output of various system commands.
  • changes almost everywhere due to SystemCommandJob taking place of FragmentJob and FragmentJob::ptr and FragmentResult::ptr requirements.
  • added FragmentWorker::dummyInit() to enforce binding of the executable to all possible derived FragmentJob's.
  • added unit test for SystemCommandJob.
  • added FragmentJobStub that implements a no-brainer job for testing.
  • NOTE: boost::iostreams is incompatible with MemDebug due to placement new.
  • Property mode set to 100644
File size: 1.4 KB
Line 
1/*
2 * Project: MoleCuilder
3 * Description: creates and alters molecular systems
4 * Copyright (C) 2011 University of Bonn. All rights reserved.
5 * Please see the LICENSE file or "Copyright notice" in builder.cpp for details.
6 */
7
8/*
9 * \file Worker.cpp
10 *
11 * This file strongly follows the Serialization example from the boost::asio
12 * library (see client.cpp)
13 *
14 * Created on: Oct 19, 2011
15 * Author: heber
16 */
17
18
19// include config.h
20#ifdef HAVE_CONFIG_H
21#include <config.h>
22#endif
23
24// boost asio needs specific operator new
25#include <boost/asio.hpp>
26
27#include "CodePatterns/MemDebug.hpp"
28
29#include <iostream>
30
31#include "atexit.hpp"
32#include "CodePatterns/Info.hpp"
33#include "CodePatterns/Log.hpp"
34#include "FragmentWorker.hpp"
35
36
37int main(int argc, char* argv[])
38{
39 // from this moment on, we need to be sure to deeinitialize in the correct order
40 // this is handled by the cleanup function
41 atexit(cleanUp);
42
43 setVerbosity(5);
44
45 size_t Exitflag = 0;
46 try
47 {
48 // Check command line arguments.
49 if (argc != 3)
50 {
51 std::cerr << "Usage: " << argv[0] << " <host> <port>" << std::endl;
52 return 1;
53 }
54
55 boost::asio::io_service io_service;
56 FragmentWorker client(io_service, argv[1], argv[2]);
57 {
58 Info info("io_service");
59 io_service.run();
60 }
61 Exitflag = client.getExitflag();
62 }
63 catch (std::exception& e)
64 {
65 std::cerr << e.what() << std::endl;
66 }
67
68
69 return Exitflag;
70}
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