Changeset d0b3aca

Timestamp:

May 4, 2012, 2:13:17 PM (13 years ago)

Author:

Frederik Heber <heber@…>

Branches:

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

Children:

72eaf7f

Parents:

e44956

git-author:

Frederik Heber <heber@…> (10/21/11 16:02:54)

git-committer:

Frederik Heber <heber@…> (05/04/12 14:13:17)

Message:

Added initial setting for creating client/server for automated fragment calculation.

• we check for boost::asio in configure.
• extra subdir src/Fragmentation/Automation to keep dependencies between new client/server architecture and rest of MoleCuilder as small as possible (especially compile-time wise).
• small worker (hello world) program that is linked against boost::asio containing first example of asio tutorial (timer.1) to underline functionality.

Files:

• Makefile.am (modified) (1 diff)
• configure.ac (modified) (3 diffs)
• src/Fragmentation/Automation/Makefile.am (added)
• src/Fragmentation/Automation/Worker.cpp (added)
• tests/CodeChecks/testsuite-config_h.at (modified) (1 diff)
• tests/CodeChecks/testsuite-memdebug.at (modified) (1 diff)

Makefile.am

@@ -1 +1 @@
 ACLOCAL_AMFLAGS = -I m4
-SUBDIRS = LinearAlgebra src src/unittests tests utils doc
+SUBDIRS = LinearAlgebra src/Fragmentation/Automation src src/unittests tests utils doc
 
 AUTOMAKE_OPTIONS = subdir-objects

configure.ac

@@ -162 +162 @@
 
 # Boost headers with libraries
+BOOST_ASIO
 BOOST_FILESYSTEM
 BOOST_PROGRAM_OPTIONS
@@ -296 +297 @@
         src/unittests/Makefile
 ])
+AC_CONFIG_FILES([
+        src/Fragmentation/Automation/Makefile
+])
+
 # produce python scripts and tests only when python's present
 AM_COND_IF([CONDPYTHON],[
@@ -305 +310 @@
         AC_CONFIG_FILES([tests/Python/Makefile])
 ])
+
 AC_OUTPUT

tests/CodeChecks/testsuite-config_h.at

@@ -1 +1 @@
 AT_SETUP([Checking for present config.h include])
 AT_KEYWORDS([CodeCheck config_h])
-ok="unity.cpp AllActionHeaders.hpp AllActionPython.hpp pugiconfig.hpp pugixml.cpp pugixml.hpp"
+ok="unity.cpp AllActionHeaders.hpp AllActionPython.hpp pugiconfig.hpp pugixml.cpp pugixml.hpp Worker.cpp"
 echo `pwd`
 echo "${#ok[*]} are ok to not contain config.h: ${ok[*]}."

tests/CodeChecks/testsuite-memdebug.at

@@ -1 +1 @@
 AT_SETUP([Checking for present MemDebug.hpp include])
 AT_KEYWORDS([CodeCheck MemDebug])
-ok="builder.cpp MemDebug.cpp SubspaceFactorizer.cpp TestRunner.cpp unity.cpp pugixml.cpp"
+ok="builder.cpp MemDebug.cpp SubspaceFactorizer.cpp TestRunner.cpp unity.cpp pugixml.cpp Worker.cpp"
 echo `pwd`
 echo "${#ok[*]} are ok to not contain MemDebug.hpp: ${ok[0]} ${ok[1]}."