De novo drug design using reinforcement learning with graph-based deep generative models
Recommended citation: Romeo Atance, Sara et al. (2021) "De novo drug design using reinforcement learning with graph-based deep generative models." ChemRxiv. link
Here, we propose a graph-based deep generative model for de novo molecular design using reinforcement learning.
Recommended citation: Romeo Atance, Sara et al. (2021) “De novo drug design using reinforcement learning with graph-based deep generative models.” ChemRxiv.