Action_Thermostats
Add_AtomRandomPerturbation
Add_RotateAroundBondAction
Add_SelectAtomByNameAction
Adding_Graph_to_ChangeBondActions
Adding_MD_integration_tests
Adding_StructOpt_integration_tests
AutomationFragmentation_failures
Candidate_v1.6.0
Candidate_v1.6.1
ChangeBugEmailaddress
ChangingTestPorts
ChemicalSpaceEvaluator
Combining_Subpackages
Debian_Package_split
Debian_package_split_molecuildergui_only
Disabling_MemDebug
Docu_Python_wait
EmpiricalPotential_contain_HomologyGraph_documentation
Enable_parallel_make_install
Enhance_userguide
Enhanced_StructuralOptimization
Enhanced_StructuralOptimization_continued
Example_ManyWaysToTranslateAtom
Exclude_Hydrogens_annealWithBondGraph
FitPartialCharges_GlobalError
Fix_ChronosMutex
Fix_StatusMsg
Fix_StepWorldTime_single_argument
Fix_Verbose_Codepatterns
ForceAnnealing_goodresults
ForceAnnealing_oldresults
ForceAnnealing_tocheck
ForceAnnealing_with_BondGraph
ForceAnnealing_with_BondGraph_continued
ForceAnnealing_with_BondGraph_continued_betteresults
ForceAnnealing_with_BondGraph_contraction-expansion
GeometryObjects
Gui_displays_atomic_force_velocity
IndependentFragmentGrids_IntegrationTest
JobMarket_RobustOnKillsSegFaults
JobMarket_StableWorkerPool
JobMarket_unresolvable_hostname_fix
ODR_violation_mpqc_open
PartialCharges_OrthogonalSummation
PythonUI_with_named_parameters
QtGui_reactivate_TimeChanged_changes
Recreated_GuiChecks
RotateToPrincipalAxisSystem_UndoRedo
StoppableMakroAction
Subpackage_levmar
Subpackage_vmg
ThirdParty_MPQC_rebuilt_buildsystem
TremoloParser_IncreasedPrecision
TremoloParser_MultipleTimesteps
Ubuntu_1604_changes
stable
|
Last change
on this file since 0035ea was 0035ea, checked in by Frederik Heber <heber@…>, 8 years ago |
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Renamed mpqc to molecuilder_mpqc to avoid install overlaps.
- molecuilder_mpqc now working in check and installcheck.
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-
Property mode
set to
100644
|
|
File size:
1.9 KB
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| 1 | AM_CPPFLAGS = -I$(top_srcdir)/include -I$(top_srcdir)/src/lib
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| 2 |
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| 3 | bin_PROGRAMS = molecuilder_mpqc
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| 4 |
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| 5 | noinst_LTLIBRARIES = libmpqc.la
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| 6 |
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| 7 | libmpqc_la_SOURCES = \
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| 8 | mpqcin.cc \
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| 9 | parse.cc \
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| 10 | parse.h \
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| 11 | scan.cc
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| 12 |
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| 13 | molecuilder_mpqc_SOURCES = \
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| 14 | mpqc.cc
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| 15 |
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| 16 | molecuilder_mpqc_CPPFLAGS = \
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| 17 | $(AM_CPPFLAGS) \
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| 18 | -DHAVE_JOBMARKET -I$(top_srcdir)/../JobMarket/src -I$(top_builddir)/../JobMarket -I$(top_srcdir)/../../src -I$(top_srcdir)/../LinearAlgebra/src $(BOOST_SYSTEM_CFLAGS) \
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| 19 | -DHAVE_MPQCDATA -I$(top_builddir)/../../src
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| 20 |
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| 21 | molecuilder_mpqc_LDFLAGS = \
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| 22 | $(AM_LDFLAGS) \
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| 23 | -L$(top_builddir)/../JobMarket/src/JobMarket/.libs -Wl,-rpath,$(top_builddir)/../JobMarket/src/JobMarket/.libs \
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| 24 | -L$(top_builddir)/../../src/.libs -Wl,-rpath,$(top_builddir)/../../src/.libs \
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| 25 | $(BOOST_SYSTEM_LDFLAGS)
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| 26 | molecuilder_mpqc_LDADD = \
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| 27 | libmpqc.la ../../lib/libSCmbpt.la ../../lib/libSCscf.la ../../lib/libSCdft.la ../../lib/libSCwfn.la ../../lib/libSCpsi.la ../../lib/libSCsolvent.la ../../lib/libSCintv3.la ../../lib/libSCbasis.la ../../lib/libSCoint3.la ../../lib/libSCmolecule.la ../../lib/libSCisosurf.la ../../lib/libSCoptimize.la ../../lib/libSCsymmetry.la ../../lib/libSCscmat.la ../../lib/libSCrender.la ../../lib/libSCgroup.la ../../lib/libSCmisc.la ../../lib/libSCstate.la ../../lib/libSCkeyval.la ../../lib/libSCclass.la ../../lib/libSCcontainer.la ../../lib/libSCref.la ../../lib/libSCoptions.la \
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| 28 | -lJobMarketPoolWorker -lJobMarket \
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| 29 | -lMolecuilderJobs -lMolecuilderFragmentationSummation \
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| 30 | -lboost_serialization
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| 31 | if COND_LIBINT
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| 32 | molecuilder_mpqc_LDADD += -lint
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| 33 | endif
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| 34 | if COND_LIBR12
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| 35 | molecuilder_mpqc_LDADD += -lr12
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| 36 | endif
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| 37 | if COND_LIBDERIV
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| 38 | molecuilder_mpqc_LDADD += -lderiv
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| 39 | endif
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| 40 |
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| 41 | #if HAVE_SC_SRC_LIB_CHEMISTRY_CCA
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| 42 | #mpqc_CPPFLAGS += -DHAVE_CHEMISTRY_CCA -DCCA_PATH=\"$(libdir)/cca\" -I../../lib/chemistry/cca
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| 43 | #mpqc_LDFLAGS += -L$(CCA_CHEM_LIB) -L$(CCAFE_LIB) -L$(CCA_SPEC_BABEL_LIB) -L$(BABEL_LIB)
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| 44 | #mpqc_LDADD += -lccachem_cxx_server -lccachem_cxx_client -lccafeCore -lcca -lsidl -lxml2 -lz
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| 45 | #endif
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