source: tests/Tesselations/testsuite.at@ 7f1b51

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 Candidate_v1.7.0 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 7f1b51 was 6253ed, checked in by Frederik Heber <heber@…>, 13 years ago

FIX: Added license disclaimer to every testfile .at of the testsuite as well.

  • so far, there was no disclaimer on the copyright of the code.
  • Property mode set to 100644
File size: 2.4 KB
Line 
1#
2# MoleCuilder - creates and alters molecular systems
3# Copyright (C) 2008-2012 University of Bonn
4#
5# This program is free software: you can redistribute it and/or modify
6# it under the terms of the GNU General Public License as published by
7# the Free Software Foundation, either version 3 of the License, or
8# (at your option) any later version.
9#
10# This program is distributed in the hope that it will be useful,
11# but WITHOUT ANY WARRANTY; without even the implied warranty of
12# MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the
13# GNU General Public License for more details.
14#
15# You should have received a copy of the GNU General Public License
16# along with this program. If not, see <http://www.gnu.org/licenses/>.
17#
18# Process with autom4te to create an -*- Autotest -*- test suite.
19#
20# see regression/... subdirs wherein for each of the cases and each check (enumerated) is a pre and post dir.
21# In pre initial files are placed, in post results can be found to be checked by diff in this testsuite.
22
23AT_INIT([Molecular Builder - Tesselations])
24AT_TESTED(diff grep egrep fgrep)
25
26# Use colored output with new-enough Autotest.
27m4_ifdef([AT_COLOR_TESTS], [AT_COLOR_TESTS])
28
29# tesselation of 1_2-dimethoxyethane
30m4_include(1_2-dimethoxyethane/testsuite-1_2-dimethoxyethane.at)
31
32# tesselation of 1_2-dimethylbenzene
33m4_include(1_2-dimethylbenzene/testsuite-1_2-dimethylbenzene.at)
34
35# tesselation of 2-methylcyclohexanone
36m4_include(2-methylcyclohexanone/testsuite-2-methylcyclohexanone.at)
37
38# tesselation of benzene
39m4_include(benzene/testsuite-benzene.at)
40
41# tesselation of cholesterol
42m4_include(cholesterol/testsuite-cholesterol.at)
43
44# tesselation of cycloheptane
45m4_include(cycloheptane/testsuite-cycloheptane.at)
46
47# tesselation of dimethyl_bromomalonate
48m4_include(dimethyl_bromomalonate/testsuite-dimethyl_bromomalonate.at)
49
50# tesselation of glucose
51m4_include(glucose/testsuite-glucose.at)
52
53# tesselation of heptan
54m4_include(heptan/testsuite-heptan.at)
55
56# tesselation of isoleucine
57m4_include(isoleucine/testsuite-isoleucine.at)
58
59# tesselation of neohexane
60m4_include(neohexane/testsuite-neohexane.at)
61
62# tesselation of N_N-dimethylacetamide
63m4_include(N_N-dimethylacetamide/testsuite-N_N-dimethylacetamide.at)
64
65# tesselation of proline
66m4_include(proline/testsuite-proline.at)
67
68# tesselation of putrescine
69m4_include(putrescine/testsuite-putrescine.at)
70
71# tesselation of tartaric_acid
72m4_include(tartaric_acid/testsuite-tartaric_acid.at)
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