rociomer

Rocío Mercado Oropeza's starred repositories

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

Language:PythonMIT79000

A comprehensive collection of recent papers on graph deep learning

MIT306400

Benchmarks for generative chemistry

Language:PythonMIT38600

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

Language:PythonMIT49900

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

Language:JavaNOASSERTION58600

GraphRNN: Generating Realistic Graphs with Deep Auto-regressive Models

Language:PythonMIT67900

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

Language:Jupyter NotebookApache-2.013400

Build Graph Nets in Tensorflow

Language:PythonApache-2.0533200

Tools and scripts I wrote and regularly use

Language:Jupyter NotebookMIT6700

NO LONGER UPDATED. Use the official repository.

Language:CNOASSERTION7300

The official sources for the RDKit library

Language:HTMLBSD-3-Clause249900