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Deep Reinforcement Learning for Multiparameter Optimization in de novo Drug Design.
Niclas Ståhl
Göran Falkman
Alexander Karlsson
Gunnar Mathiason
Jonas Boström
Published in:
J. Chem. Inf. Model. (2019)
Keyphrases
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drug design
reinforcement learning
optimization problems
drug discovery
protein protein interactions
protein structure prediction
databases
machine learning
wireless sensor networks
dynamic programming
knowledge discovery
energy consumption
machine learning methods
protein sequences