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Using Molecular Embeddings in QSAR Modeling: Does it Make a Difference?
20 March 2021
María Virginia Sabando
I. Ponzoni
E. Milios
Axel J. Soto
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Papers citing
"Using Molecular Embeddings in QSAR Modeling: Does it Make a Difference?"
2 / 2 papers shown
Machine Guided Discovery of Novel Carbon Capture Solvents
James L. McDonagh
Benjamin H. Wunsch
Stamatia Zavitsanou
Alexander Harrison
Bruce Elmegreen
S. Gifford
T. Kessel
F. Cipcigan
76
4
0
24 Mar 2023
Exploring QSAR Models for Activity-Cliff Prediction
Journal of Cheminformatics (J Cheminform), 2023
Markus Dablander
Thierry Hanser
R. Lambiotte
Garrett M. Morris
266
42
0
31 Jan 2023
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