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NonConvexEnvelope-round_cluster.dat@ 6a7f78c

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Last change on this file since 6a7f78c was 6a7f78c, checked in by Frederik Heber <heber@…>, 15 years ago

Fixes and naming of final Tecplot output file is now molecule name.

FIXES to builder.cpp:
- case 'p' would not dissect the molecule into connected subgraphs
- if done so, the BondGraph was not yet initialised
- if done so, we need to check whether BondGraphFileName has been set
- BondGraphFileName.empty() could not be used as a check, as was set to "" instead of "\n"
- if (finally) done so, we have to remove the empty molecule that we parsed in
- ... and then pick the newly added molecule for mol to point at
- SaveConfig() did not set the merged molecule name correctly.
- if empty config is given, the empty molecule now receives the ConfigFileName as name

FIXES to config.cpp
- Load() did not set the name of the molecule

changes to tesselationhelper.cpp and tesselation.cpp
- WriteTecplotFile() uses N == -1 to make clear, that we are writing the final not a temporary tecplot file and then uses the molecule's name instead of the last triangle's endpoints
- FindNextSuitableTriangle(): HasOtherBaselineBetterCandidate() was commented out for the moment (as it is not yet final and makes all the test fail)
- IncludeSphereinRaster3D() did not check whether LastTriangle was NULL or not

MoleculeListClass::DissectMoleculeIntoConnectedSubgraphs() names the subgraphs with suffixes "..-1", "..-2", ...

changes to PointCloud and molecule
- new virtual function PointCloud::GetName() returns "unknown"
- new function molecule::GetName() returns pointer to name of molecule
- IsEmpty() and IsEnd() now return true by default

all .dat files in the "Tesselations" tests were changed accordingly (i.e. have now the name in the second line)
benzene was added as a new test for an absolutely flat molecule. So far, it fails horribly.
13 of 17 tests run fine

Signed-off-by: Frederik Heber <heber@…>

Property mode set to 100644

File size: 22.0 KB

Line
1	TITLE = "3D CONVEX SHELL"
2	VARIABLES = "X" "Y" "Z" "U"
3	ZONE T="round_cluster", N=467, E=930, DATAPACKING=POINT, ZONETYPE=FETRIANGLE
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