Transformer-based artificial neural networks for the conversion between chemical notations
Keyword(s):
AbstractWe developed a Transformer-based artificial neural approach to translate between SMILES and IUPAC chemical notations: Struct2IUPAC and IUPAC2Struct. The overall performance level of our model is comparable to the rule-based solutions. We proved that the accuracy and speed of computations as well as the robustness of the model allow to use it in production. Our showcase demonstrates that a neural-based solution can facilitate rapid development keeping the required level of accuracy. We believe that our findings will inspire other developers to reduce development costs by replacing complex rule-based solutions with neural-based ones.
1993 ◽
Vol 24
(7)
◽
pp. 1415-1418
◽
Keyword(s):
1994 ◽
Vol 11
(5)
◽
pp. 497-507
◽
Keyword(s):
Keyword(s):
2021 ◽
Vol 4
(2)
◽
pp. 1-7
Keyword(s):
2021 ◽
1999 ◽
Vol 17
(2)
◽
pp. 169-176
◽
Keyword(s):
2014 ◽
Vol 2
(3)
◽
pp. 720-734
◽
2020 ◽