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Investigation of chemical structure recognition by encoder–decoder models in learning progress

Abstract Descriptor generation methods using latent representations of encoder–decoder (ED) models with SMILES as input are useful because of the continuity of descriptor and restorability to the structure. However, it is not clear how the structure is recognized in the learning progress of ED model...

Бүрэн тодорхойлолт

-д хадгалсан:
Номзүйн дэлгэрэнгүй
Үндсэн зохиолчид: Shumpei Nemoto, Tadahaya Mizuno, Hiroyuki Kusuhara
Формат: Artigo
Хэл сонгох:Inglês
Хэвлэсэн: BMC 2023-04-01
Цуврал:Journal of Cheminformatics
Нөхцлүүд:
Онлайн хандалт:https://doi.org/10.1186/s13321-023-00713-z
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