"Bidirectional Graphormer for Reactivity Understanding: Neural Network ..."

Ramil I. Nugmanov et al. (2022)

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DOI: 10.1021/ACS.JCIM.2C00344

access: closed

type: Journal Article

metadata version: 2022-08-08

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Ramil I. Nugmanov, Natalia Dyubankova, Andrey Gedich, Jörg Kurt Wegner:
Bidirectional Graphormer for Reactivity Understanding: Neural Network Trained to Reaction Atom-to-Atom Mapping Task. J. Chem. Inf. Model. 62(14): 3307-3315 (2022)

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