Name | Date | Size | #Lines | LOC | ||
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.. | 03-May-2022 | - | ||||
README | H A D | 26-Jul-2019 | 826 | 28 | 21 | |
molecule_00_0.dimacs | H A D | 26-Jul-2019 | 904 | 95 | 94 | |
molecule_01_0.dimacs | H A D | 26-Jul-2019 | 76.6 KiB | 5,540 | 5,539 | |
molecule_02_0.dimacs | H A D | 26-Jul-2019 | 39 | 3 | 2 | |
molecule_03_0.dimacs | H A D | 26-Jul-2019 | 309 | 38 | 37 | |
molecule_04_0.dimacs | H A D | 26-Jul-2019 | 414 | 50 | 49 | |
molecule_05_0.dimacs | H A D | 26-Jul-2019 | 174 | 21 | 20 | |
molecule_06_0.dimacs | H A D | 26-Jul-2019 | 712 | 74 | 73 | |
molecule_07_0.dimacs | H A D | 26-Jul-2019 | 4.2 KiB | 350 | 349 | |
molecule_08_0.dimacs | H A D | 26-Jul-2019 | 1.1 KiB | 105 | 104 | |
molecule_09_0.dimacs | H A D | 26-Jul-2019 | 1.2 KiB | 114 | 113 | |
molecule_10_0.dimacs | H A D | 26-Jul-2019 | 5.4 KiB | 452 | 451 | |
molecule_11_0.dimacs | H A D | 26-Jul-2019 | 1.6 KiB | 151 | 150 | |
molecule_12_0.dimacs | H A D | 26-Jul-2019 | 821 | 84 | 83 | |
molecule_13_0.dimacs | H A D | 26-Jul-2019 | 896 | 95 | 94 | |
molecule_14_0.dimacs | H A D | 26-Jul-2019 | 650 | 66 | 65 | |
molecule_15_0.dimacs | H A D | 26-Jul-2019 | 1.2 KiB | 125 | 124 | |
molecule_16_0.dimacs | H A D | 26-Jul-2019 | 369 | 41 | 40 | |
molecule_17_0.dimacs | H A D | 26-Jul-2019 | 487 | 52 | 51 | |
molecule_18_0.dimacs | H A D | 26-Jul-2019 | 1.2 KiB | 128 | 127 | |
molecule_19_0.dimacs | H A D | 26-Jul-2019 | 15.5 KiB | 1,239 | 1,238 | |
molecule_20_0.dimacs | H A D | 26-Jul-2019 | 30.1 KiB | 2,565 | 2,564 | |
molecule_21_0.dimacs | H A D | 26-Jul-2019 | 383 | 44 | 43 | |
molecule_22_0.dimacs | H A D | 26-Jul-2019 | 2 KiB | 210 | 209 | |
molecule_23_0.dimacs | H A D | 26-Jul-2019 | 744 | 85 | 84 | |
molecule_24_0.dimacs | H A D | 26-Jul-2019 | 982 | 103 | 102 | |
molecule_25_0.dimacs | H A D | 26-Jul-2019 | 352 | 39 | 38 |
README
1These testfiles contain interesting graphs, 2that are challenging and led to errors in the 3past (regression tests). 4 5The files are in a extended DIMACS graph format 6(http://lcs.ios.ac.cn/~caisw/Resource/about_DIMACS_graph_format.txt). 7 8Comment lines start with 'c' and are ignored. 9The first line must be 10p edge <nof_nodes> <nof_edges> <nof_rings> 11 12Then the edges follow as 13e <node1> <node2> 14 15Finally the rings are specified as for each edge (node1, node2) 16r <ring_id> <ring_size> <node1> <node2> 17 18The rings in these files are the relevant cycles calculated 19by NAOMI. 20 21The structures are either simple molecules, 22totally artificial, 23or graph topological abstractions of 24molecules from the PubChem (https://pubchem.ncbi.nlm.nih.gov/) 25(SID and CID given in test files). 26All chemical information (bond type, element) 27was removed. 28