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Machine learning transition state geometries and applications in reaction property prediction (2025)

First Author: Beaglehole I

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/10.26434/chemrxiv-2024-wdtz9-v3

Publication URI: http://dx.doi.org/10.26434/chemrxiv-2024-wdtz9-v3

Type: Preprint