| [6253ed] | 1 | # | 
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|  | 2 | #    MoleCuilder - creates and alters molecular systems | 
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|  | 3 | #    Copyright (C) 2008-2012 University of Bonn | 
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|  | 4 | # | 
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|  | 5 | #    This program is free software: you can redistribute it and/or modify | 
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|  | 6 | #    it under the terms of the GNU General Public License as published by | 
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|  | 7 | #    the Free Software Foundation, either version 3 of the License, or | 
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|  | 8 | #    (at your option) any later version. | 
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|  | 9 | # | 
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|  | 10 | #    This program is distributed in the hope that it will be useful, | 
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|  | 11 | #    but WITHOUT ANY WARRANTY; without even the implied warranty of | 
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|  | 12 | #    MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE.  See the | 
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|  | 13 | #    GNU General Public License for more details. | 
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|  | 14 | # | 
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|  | 15 | #    You should have received a copy of the GNU General Public License | 
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|  | 16 | #    along with this program.  If not, see <http://www.gnu.org/licenses/>. | 
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|  | 17 | # | 
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| [a85f45] | 18 | # Process with autom4te to create an -*- Autotest -*- test suite. | 
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|  | 19 | # | 
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|  | 20 | # see regression/... subdirs wherein for each of the cases and each check (enumerated) is a pre and post dir. | 
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|  | 21 | # In pre initial files are placed, in post results can be found to be checked by diff in this testsuite. | 
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|  | 22 |  | 
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|  | 23 | AT_INIT([Molecular Builder - Tesselations]) | 
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|  | 24 | AT_TESTED(diff grep egrep fgrep) | 
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|  | 25 |  | 
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|  | 26 | # Use colored output with new-enough Autotest. | 
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|  | 27 | m4_ifdef([AT_COLOR_TESTS], [AT_COLOR_TESTS]) | 
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|  | 28 |  | 
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| [33ee99] | 29 | ### NONCONVEX TESSELATION | 
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|  | 30 |  | 
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| [a85f45] | 31 | # tesselation of 1_2-dimethoxyethane | 
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| [33ee99] | 32 | m4_include(NonConvex/1_2-dimethoxyethane/testsuite-1_2-dimethoxyethane.at) | 
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| [a85f45] | 33 |  | 
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|  | 34 | # tesselation of 1_2-dimethylbenzene | 
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| [33ee99] | 35 | m4_include(NonConvex/1_2-dimethylbenzene/testsuite-1_2-dimethylbenzene.at) | 
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| [a85f45] | 36 |  | 
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|  | 37 | # tesselation of 2-methylcyclohexanone | 
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| [33ee99] | 38 | m4_include(NonConvex/2-methylcyclohexanone/testsuite-2-methylcyclohexanone.at) | 
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|  | 39 |  | 
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|  | 40 | # tesselation of benzene | 
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|  | 41 | m4_include(NonConvex/benzene/testsuite-benzene.at) | 
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|  | 42 |  | 
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|  | 43 | # tesselation of cholesterol | 
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|  | 44 | m4_include(NonConvex/cholesterol/testsuite-cholesterol.at) | 
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|  | 45 |  | 
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|  | 46 | # tesselation of cycloheptane | 
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|  | 47 | m4_include(NonConvex/cycloheptane/testsuite-cycloheptane.at) | 
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|  | 48 |  | 
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|  | 49 | # tesselation of dimethyl_bromomalonate | 
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|  | 50 | m4_include(NonConvex/dimethyl_bromomalonate/testsuite-dimethyl_bromomalonate.at) | 
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|  | 51 |  | 
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|  | 52 | # tesselation of glucose | 
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|  | 53 | m4_include(NonConvex/glucose/testsuite-glucose.at) | 
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|  | 54 |  | 
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|  | 55 | # tesselation of heptan | 
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|  | 56 | m4_include(NonConvex/heptan/testsuite-heptan.at) | 
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|  | 57 |  | 
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|  | 58 | # tesselation of isoleucine | 
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|  | 59 | m4_include(NonConvex/isoleucine/testsuite-isoleucine.at) | 
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|  | 60 |  | 
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|  | 61 | # tesselation of neohexane | 
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|  | 62 | m4_include(NonConvex/neohexane/testsuite-neohexane.at) | 
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|  | 63 |  | 
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|  | 64 | # tesselation of N_N-dimethylacetamide | 
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|  | 65 | m4_include(NonConvex/N_N-dimethylacetamide/testsuite-N_N-dimethylacetamide.at) | 
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|  | 66 |  | 
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|  | 67 | # tesselation of proline | 
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|  | 68 | m4_include(NonConvex/proline/testsuite-proline.at) | 
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|  | 69 |  | 
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|  | 70 | # tesselation of putrescine | 
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|  | 71 | m4_include(NonConvex/putrescine/testsuite-putrescine.at) | 
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|  | 72 |  | 
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|  | 73 | # tesselation of tartaric_acid | 
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|  | 74 | m4_include(NonConvex/tartaric_acid/testsuite-tartaric_acid.at) | 
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|  | 75 |  | 
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|  | 76 | ### NONCONVEX TESSELATION | 
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|  | 77 |  | 
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|  | 78 | # tesselation of 1_2-dimethoxyethane | 
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|  | 79 | m4_include(Convex/1_2-dimethoxyethane/testsuite-1_2-dimethoxyethane.at) | 
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|  | 80 |  | 
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|  | 81 | # tesselation of 1_2-dimethylbenzene | 
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|  | 82 | m4_include(Convex/1_2-dimethylbenzene/testsuite-1_2-dimethylbenzene.at) | 
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|  | 83 |  | 
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|  | 84 | # tesselation of 2-methylcyclohexanone | 
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|  | 85 | m4_include(Convex/2-methylcyclohexanone/testsuite-2-methylcyclohexanone.at) | 
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|  | 86 |  | 
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|  | 87 | # tesselation of amylose | 
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|  | 88 | m4_include(Convex/amylose/testsuite-amylose.at) | 
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| [a85f45] | 89 |  | 
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|  | 90 | # tesselation of benzene | 
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| [33ee99] | 91 | m4_include(Convex/benzene/testsuite-benzene.at) | 
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| [a85f45] | 92 |  | 
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|  | 93 | # tesselation of cholesterol | 
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| [33ee99] | 94 | m4_include(Convex/cholesterol/testsuite-cholesterol.at) | 
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| [a85f45] | 95 |  | 
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|  | 96 | # tesselation of cycloheptane | 
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| [33ee99] | 97 | m4_include(Convex/cycloheptane/testsuite-cycloheptane.at) | 
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| [a85f45] | 98 |  | 
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|  | 99 | # tesselation of dimethyl_bromomalonate | 
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| [33ee99] | 100 | m4_include(Convex/dimethyl_bromomalonate/testsuite-dimethyl_bromomalonate.at) | 
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| [a85f45] | 101 |  | 
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|  | 102 | # tesselation of glucose | 
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| [33ee99] | 103 | m4_include(Convex/glucose/testsuite-glucose.at) | 
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| [a85f45] | 104 |  | 
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|  | 105 | # tesselation of heptan | 
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| [33ee99] | 106 | m4_include(Convex/heptan/testsuite-heptan.at) | 
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| [a85f45] | 107 |  | 
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|  | 108 | # tesselation of isoleucine | 
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| [33ee99] | 109 | m4_include(Convex/isoleucine/testsuite-isoleucine.at) | 
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| [a85f45] | 110 |  | 
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|  | 111 | # tesselation of neohexane | 
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| [33ee99] | 112 | m4_include(Convex/neohexane/testsuite-neohexane.at) | 
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| [a85f45] | 113 |  | 
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|  | 114 | # tesselation of N_N-dimethylacetamide | 
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| [33ee99] | 115 | m4_include(Convex/N_N-dimethylacetamide/testsuite-N_N-dimethylacetamide.at) | 
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| [a85f45] | 116 |  | 
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|  | 117 | # tesselation of proline | 
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| [33ee99] | 118 | m4_include(Convex/proline/testsuite-proline.at) | 
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| [a85f45] | 119 |  | 
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|  | 120 | # tesselation of putrescine | 
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| [33ee99] | 121 | m4_include(Convex/putrescine/testsuite-putrescine.at) | 
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| [a85f45] | 122 |  | 
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|  | 123 | # tesselation of tartaric_acid | 
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| [33ee99] | 124 | m4_include(Convex/tartaric_acid/testsuite-tartaric_acid.at) | 
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