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UnCorrupt SMILES: a novel approach to de novo design.
Linde Schoenmaker
O. J. M. Béquignon
Willem Jespers
Gerard J. P. van Westen
Published in:
J. Cheminformatics (2023)
Keyphrases
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engineering design
building blocks
computer aided
data structure
design process
design decisions
data sets
machine learning
computer vision
e learning
image processing
case study
learning environment