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Integrating synthetic accessibility with AI-based generative drug design.
Maud Parrot
Hamza Tajmouati
Vinicius Barros Ribeiro da Silva
Brian Ross Atwood
Robin Fourcade
Yann Gaston-Mathé
Nicolas Do Huu
Quentin Perron
Published in:
J. Cheminformatics (2023)
Keyphrases
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drug design
artificial intelligence
protein structure prediction
quantitative structure activity
protein protein interactions
knowledge representation
essential proteins
drug discovery
databases
real world
machine learning
network structure
high precision