Each and every atom counts: Predicting websites of response in line with chemistry inside of two bonds

Digital Discovery, 2024, Accepted Manuscript
DOI: 10.1039/D4DD00092G, Paper

Open Access

&nbsp This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.

Ching Ching Lam, Jonathan Goodman
How much chemistry can be described by looking only at each atom, its neighbours and its next-nearest neighbours? We present a method for predicting reaction sites based only on a…
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