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Chemical reactivity predictions: Use of data mining techniques for analyzing regioselective azidolysis of epoxides
Authors:Alice Borghini  Paolo Crotti  Daniele Pietra  Lucilla Favero  Anna Maria Bianucci
Institution:Dipartimento di Scienze Farmaceutiche, Università di Pisa, Via Bonanno 6, Pisa 56126, Italy
Abstract:
Keywords:chemical reactivity prediction  azidolysis  oxiranes  multiple linear regression  k‐nearest neighbor  locally weighted regression  Gaussian Process regression  quantitative structure‐property relationships (QSPR)
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