source: src/Fragmentation/Automation/FragmentWorker.cpp@ 95454a

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 95454a was 95454a, checked in by Frederik Heber <heber@…>, 13 years ago

Refactored main part in FragmentWorker into WorkOnJobOperation.

  • essentially FragmentWorker just contains this Operation and nothing else.
  • Property mode set to 100644
File size: 1.6 KB
RevLine 
[2eff32]1/*
[cd4a6e]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 FragmentWorker.cpp
10 *
11 * This file strongly follows the Serialization example from the boost::asio
12 * library (see client.cpp).
[2eff32]13 *
14 * Created on: Nov 18, 2011
15 * Author: heber
16 */
17
[f93842]18// include config.h
19#ifdef HAVE_CONFIG_H
20#include <config.h>
21#endif
22
[00d4fb]23// boost asio needs specific operator new
[2eff32]24#include <boost/asio.hpp>
[00d4fb]25
26#include "CodePatterns/MemDebug.hpp"
27
[2eff32]28#include <boost/bind.hpp>
29#include <iostream>
30#include <vector>
[af3aed]31#include "Connection.hpp" // Must come before boost/serialization headers.
[2eff32]32#include <boost/serialization/vector.hpp>
[af3aed]33#include "CodePatterns/Info.hpp"
[b0b64c]34#include "CodePatterns/Log.hpp"
[f0834d]35#include "Jobs/FragmentJob.hpp"
[306f60]36#include "Jobs/MPQCCommandJob.hpp"
[d920b9]37#include "Jobs/SystemCommandJob.hpp"
[7670865]38#include "Results/FragmentResult.hpp"
[cd4a6e]39#include "FragmentWorker.hpp"
[2eff32]40
[d920b9]41/** Helper function to enforce binding of FragmentWorker to possible derived
42 * FragmentJob classes.
43 */
44void dummyInit() {
45 SystemCommandJob("/bin/false", "something", JobId::IllegalJob);
[306f60]46 MPQCCommandJob("nofile", JobId::IllegalJob);
[d920b9]47}
48
[a636f8]49/// Constructor starts the asynchronous connect operation.
[8c9596]50FragmentWorker::FragmentWorker(
[a636f8]51 boost::asio::io_service& io_service,
52 const std::string& host,
53 const std::string& service) :
[a1b77d]54 connection_(io_service),
[95454a]55 operation(connection_)
[a636f8]56{
[af3aed]57 Info info(__FUNCTION__);
[a636f8]58
[95454a]59 // launch operation
60 operation(host, service);
[ef2767]61}
62
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