December 1, 2018Open Access

Convolutional neural network based on SMILES representation of compounds for detecting chemical motif

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Abstract

The source code of our SMILES-based convolutional neural network software in the deep learning framework Chainer is available at http://www.dna.bio.keio.ac.jp/smiles/ , and the dataset used for performance evaluation in this work is available at the same URL.

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Hirohara et al. (Sat,) studied this question.

synapsesocial.com/papers/69ded5a741e0955b99b0bd69 https://doi.org/https://doi.org/10.1186/s12859-018-2523-5

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