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 f37746 was 260c29, checked in by Frederik Heber <heber@…>, 15 years ago |
Regression test of Tesselation for test case 15 "Big non-convex envelope" changed.
- the sequence of the triangles had changed due to the changes in the algorithm. The surface itself has not changed (checked).
Signed-off-by: Frederik Heber <heber@…>
|
-
Property mode
set to
100644
|
File size:
1.9 KB
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Line | |
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1 | TITLE = "3D CONVEX SHELL"
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2 | VARIABLES = "X" "Y" "Z" "U"
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3 | ZONE T="test", N=44, E=86, DATAPACKING=POINT, ZONETYPE=FETRIANGLE
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4 | 6.9077 1.1106 0.1214 1
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5 | 0.3612 -3.628 1.323 1
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6 | 0.4884 -3.5983 -0.4521 3
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7 | 1.4985 -2.5112 0.5308 4
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8 | -1.9534 -3.5752 0.5362 2
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9 | -1.1883 -0.199 1.5176 3
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10 | -0.7165 -1.6046 2.5129 1
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11 | 1.7627 -1.4479 -0.8349 4
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12 | -1.003 -1.3584 -2.8848 2
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13 | 0.0217 -2.6629 -2.2008 1
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14 | -2.8885 -1.5706 1.7543 2
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15 | -2.0579 -3.6765 -1.7622 0
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16 | -2.9259 -2.1146 -1.7672 1
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17 | 1.0353 0.1785 2.542 3
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18 | 1.6325 -1.3323 1.8306 2
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19 | 0.7271 1.177 0.3594 3
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20 | 1.3374 -0.2942 -2.961 2
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21 | 0.6036 1.0859 -2.1126 3
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22 | -3.2034 -0.5041 -1.0881 3
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23 | -5.1809 -1.8679 0.9687 1
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24 | -4.6025 -2.4721 -0.6025 2
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25 | -4.3385 -3.4329 0.8725 0
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26 | 3.191 1.3217 -2.8354 1
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27 | -4.0905 0.6312 1.6028 3
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28 | 2.8131 1.4776 2.5103 0
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29 | 3.9137 2.2936 1.3739 0
|
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30 | 2.159 2.5738 1.2698 5
|
---|
31 | 3.6606 -0.4593 2.1396 2
|
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32 | 3.2007 -1.4419 0.7311 4
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33 | -3.3002 2.3589 0.0094 8
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34 | -4.377 1.6962 -1.2433 3
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35 | 5.2593 1.4547 -1.7445 0
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36 | 4.6863 2.7674 -0.6775 0
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37 | 5.746 -0.9031 1.204 0
|
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38 | 5.1212 -0.8867 -0.4582 4
|
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39 | -5.2641 2.8314 1.4476 0
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40 | 5.2727 1.6068 1.2828 2
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41 | -6.2394 4.6427 0.0632 0
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42 | -4.4738 4.5591 -0.1458 3
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43 | -5.5506 3.8964 -1.3985 0
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44 | -6.7081 0.9923 0.6224 2
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45 | -7.5442 2.5597 0.5118 0
|
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46 | -6.8554 1.8134 -0.9499 1
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47 | 7.1391 2.0447 0.0264 0
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48 |
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49 | 1 32 44
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50 | 1 32 35
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51 | 1 34 35
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52 | 23 32 35
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53 | 17 23 35
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54 | 8 17 35
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55 | 8 10 17
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56 | 3 8 10
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57 | 3 8 35
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58 | 3 4 35
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59 | 4 29 35
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60 | 29 34 35
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61 | 2 3 4
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62 | 2 4 29
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63 | 2 15 29
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64 | 15 28 29
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65 | 28 29 34
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66 | 2 7 15
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67 | 7 14 15
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68 | 14 15 28
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69 | 14 25 28
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70 | 25 28 37
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71 | 28 34 37
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72 | 1 34 37
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73 | 1 37 44
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74 | 25 26 37
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75 | 25 26 27
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76 | 26 27 33
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77 | 26 33 44
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78 | 26 37 44
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79 | 14 25 27
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80 | 14 27 30
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81 | 6 14 30
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82 | 6 24 30
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83 | 24 30 36
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84 | 30 36 39
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85 | 27 30 39
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86 | 27 30 39
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87 | 16 27 30
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88 | 16 18 30
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89 | 16 18 27
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90 | 18 27 33
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91 | 18 23 33
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92 | 6 7 24
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93 | 6 7 14
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94 | 7 11 24
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95 | 11 20 24
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96 | 20 24 41
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97 | 24 36 41
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98 | 36 41 42
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99 | 11 20 22
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100 | 5 11 22
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101 | 5 7 11
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102 | 2 5 7
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103 | 36 38 39
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104 | 36 38 42
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105 | 18 30 31
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106 | 30 31 39
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107 | 31 39 40
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108 | 9 18 31
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109 | 9 17 18
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110 | 17 18 23
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111 | 9 19 31
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112 | 9 13 19
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113 | 13 19 31
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114 | 13 21 31
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115 | 21 31 43
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116 | 31 40 43
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117 | 9 12 13
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118 | 9 10 12
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119 | 9 10 17
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120 | 12 13 21
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121 | 12 21 22
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122 | 5 12 22
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123 | 3 5 12
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124 | 2 3 5
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125 | 3 10 12
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126 | 20 21 22
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127 | 20 21 41
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128 | 21 41 43
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129 | 41 42 43
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130 | 23 32 33
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131 | 32 33 44
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132 | 40 42 43
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133 | 38 40 42
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134 | 38 39 40
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