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graphkit-learn
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graphkit-learn/datasets/Alkane/molecule017.ct

molecule017.ct 325 B
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add datasets and remove some files not needed.
6 years ago
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  1. molecule016.ct

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  6.     0.3750   -1.9486    0.0000 C

  7.     1.8750   -1.9486    0.0000 C

  8.    -1.8750   -0.6495    0.0000 C

  9.     1.8750    0.6495    0.0000 C

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