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Exploiting Vector Pattern Diversity of Molecular Scaffolds for Cheminformatics Tasks in Drug Discovery.
Daniela Dolciami
Robert M. Ziolek
Daniel W. Davies
Michael Carter
N. Yi Mok
Richard Sherhod
Published in:
J. Chem. Inf. Model. (2024)
Keyphrases
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drug discovery
virtual screening
chemical compounds
pharmaceutical industry
quantitative structure activity
early stage
drug design
scientific data
systems biology
data mining tools
discovery process
biological systems
pattern discovery
decision trees
computational model
data management
data analysis