Predictive deep learning models for environmental properties: the direct calculation of octanol–water partition coefficients from molecular graphs
Keyword(s):
A deep learning approach coupling the Tree-LSTM network and back-propagation neural network for predicting the octanol–water partition coefficient.
2020 ◽
Vol 11
(1)
◽
pp. 219-229
Keyword(s):
2018 ◽
Vol 7
(3.34)
◽
pp. 237
Keyword(s):
Keyword(s):