Molecular Design in Synthetically Accessible Chemical Space via Deep Reinforcement Learning.

Julien Horwood Emmanuel Noutahi

Published in: CoRR (2020)

Keyphrases

reinforcement learning
case study
design space
website
three dimensional
search algorithm
design methodology
function approximation
state space
chemical engineering
drug discovery
computer aided
space time
knowledge based systems
object oriented
real time
dynamic programming
search space
artificial intelligence