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  • tests/regression/Tesselation/Convex/testsuite-tesselation-convex-envelope.at

    r0d97b4 rbcb831  
    2424AT_CHECK([/bin/cp -f ${abs_top_srcdir}/tests/regression/Tesselation/Convex/pre/test.conf $file], 0)
    2525convexfile=ConvexEnvelope
    26 AT_CHECK([../../molecuilder -i $file  --select-molecule-by-id 0 --convex-envelope --convex-file $convexfile --nonconvex-file NonConvexEnvelope], 0, [stdout], [stderr])
     26AT_CHECK([../../molecuilder -i $file  --select-molecule-by-id 0 --convex-envelope 50. --convex-file $convexfile --nonconvex-file NonConvexEnvelope], 0, [stdout], [stderr])
    2727AT_CHECK([diff ${convexfile}.dat ${abs_top_srcdir}/tests/regression/Tesselation/Convex/post/ConvexEnvelope.dat], 0, [ignore], [ignore])
    2828#AT_CHECK([diff ${convexfile}.r3d ${abs_top_srcdir}/tests/regression/Tesselation/Convex/post/ConvexEnvelope.r3d], 0, [ignore], [ignore])
    29 AT_CHECK([fgrep "tesselated volume area is 16.4016 angstrom^3" stdout], 0, [ignore], [ignore])
     29AT_CHECK([fgrep "tesselated volume area is 8.89109 angstrom^3" stdout], 0, [ignore], [ignore])
    3030AT_CHECK([diff ConvexEnvelope.dat NonConvexEnvelope.dat], 0, [ignore], [ignore])
    3131
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