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Predicting retrosynthetic pathways using transformer-based models and a hyper-graph exploration strategy

Crossref DOI link: https://doi.org/10.1039/c9sc05704h

Published Online: 2020

Update policy: https://doi.org/10.1039/rsc_crossmark_policy

Authors

Schwaller, Philippe https://orcid.org/0000-0003-3046-6576
Petraglia, Riccardo

Zullo, Valerio

Nair, Vishnu H.

Haeuselmann, Rico Andreas

Pisoni, Riccardo

Bekas, Costas

Iuliano, Anna https://orcid.org/0000-0002-6805-3366
Laino, Teodoro
License Information

Version of Record valid from 2020-03-03
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SIMILARITY CHECK

: This document is Similarity Check deposited

RELATED DATA

: Supplementary Information

IDENTIFIERS

: Philippe Schwaller (ORCID)

: Anna Iuliano (ORCID)

PEER REVIEW METHOD

: Single-blind

PUBLICATION HISTORY

: Received 11 November 2019; Accepted 2 March 2020; Accepted Manuscript published 3 March 2020; Advance Article published 9 March 2020; Version of Record published 25 March 2020