Convolutional Networks on Graphs for Learning Molecular Fingerprints Convolutional Networks on Graphs for Learning Molecular Fingerprints
Paper summary https://github.com/HIPS/neural-fingerprint http://www.gitxiv.com/posts/DFtFytneou3SXLuSM/convolutional-networks-on-graphs-for-learning-molecular
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Convolutional Networks on Graphs for Learning Molecular Fingerprints
David Duvenaud and Dougal Maclaurin and Jorge Aguilera-Iparraguirre and Rafael Gómez-Bombarelli and Timothy Hirzel and Alán Aspuru-Guzik and Ryan P. Adams
arXiv e-Print archive - 2015 via Local arXiv
Keywords: cs.LG, cs.NE, stat.ML

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