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Scaffold-Constrained Molecular Generation.
Maxime Langevin
Hervé Minoux
Maximilien Levesque
Marc Bianciotto
Published in:
J. Chem. Inf. Model. (2020)
Keyphrases
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similarity measure
pairwise
drug discovery
databases
decision making
image processing
optimal solution
learning environment
natural language
fine grained
molecular structure