Artigo Revisado por pares

Retrosynthesis from transforms to predictive sustainable chemistry and nanotechnology: a brief tutorial review

2023; Royal Society of Chemistry; Volume: 25; Issue: 8 Linguagem: Inglês

10.1039/d2gc04750k

ISSN

1463-9270

Autores

Alicja Mikołajczyk, Uladzislau Zhdan, Sylvain Antoniotti, Adam Smoliński, Karolina Jagiełło, Piotr Skurski, Moussab Harb, Tomasz Puzyn, Jarosław Polański,

Tópico(s)

Machine Learning in Materials Science

Resumo

Retrosynthesis is a tool initially developed to simplify the planning of the synthesis of organic molecules. With the progress of computer-aided synthesis design (CASD), its development will be predictive green and sustainable CASD.

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