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Predicting Physical−Chemical Properties of Compounds from Molecular Structures by Recursive Neural Networks

✍ Scribed by Bernazzani, Luca; Duce, Celia; Micheli, Alessio; Mollica, Vincenzo; Sperduti, Alessandro; Starita, Antonina; Tiné, Maria Rosaria


Book ID
119960319
Publisher
American Chemical Society
Year
2006
Tongue
English
Weight
334 KB
Volume
46
Category
Article
ISSN
0095-2338

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## Abstract **Summary:** We propose a new approach for predicting polymer properties from structured molecular representations based on recursive neural networks. To this aim, a structured representation is designed for the modeling of polymer structures. This representation can also account for av