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graphkit-learn
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graphkit-learn/datasets/Alkane/molecule003.ct

molecule003.ct 143 B
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add datasets and remove some files not needed.
6 years ago
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  1. molecule2.ct

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  3.     1.2990   -0.3750    0.0000 C

  4.     0.0000    0.3750    0.0000 C

  5.    -1.2990   -0.3750    0.0000 C

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A Python package for graph kernels, graph edit distances and graph pre-image problem.