rociomer

Rocío Mercado Oropeza's starred repositories

Build Graph Nets in Tensorflow

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A comprehensive collection of recent papers on graph deep learning

The official sources for the RDKit library

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Molecular Sets (MOSES): A Benchmarking Platform for Molecular Generation Models

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GraphRNN: Generating Realistic Graphs with Deep Auto-regressive Models

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Bash and shell script language support for JetBrains IDEs. Please refer to www.bashsupport.com/news/bashsupport-pro-1.3/ for the reasons.

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Junction Tree Variational Autoencoder for Molecular Graph Generation (ICML 2018)

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Benchmarks for generative chemistry

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Code for "Multi-Objective De Novo Drug Design with Conditional Graph Generative Model" (https://arxiv.org/abs/1801.07299)

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NO LONGER UPDATED. Use the official repository.

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Tools and scripts I wrote and regularly use

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