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Machine learning reaction barriers in low data regimes: a horizontal and diagonal transfer learning approach (2023)

First Author: Espley S

Attributed to: Machine Learning and Molecular Modelling: A Synergistic Approach to Rapid Reactivity Prediction funded by EPSRC

Abstract

No abstract provided

Bibliographic Information

Digital Object Identifier: http://dx.doi.org/10.1039/d3dd00085k

Publication URI: http://dx.doi.org/10.1039/d3dd00085k

Type: Journal Article/Review

Parent Publication: Digital Discovery

Issue: 4