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Interpretability of SAR/QSAR Models of any Complexity by Atomic Contributions
Interpretability of SAR/QSAR Models of any Complexity by Atomic Contributions
2012
Gilles Marcou
Dragos Horvath
V. Solovev
Alban Arrault
Philippe Vayer
Alexandre Varnek
Keywords:
Combinatorial chemistry
Cheminformatics
Machine learning
Stereochemistry
Artificial intelligence
Chemistry
Quantitative structure–activity relationship
Interpretability
aqueous solubility
Correction
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