Title
Optimizing Recurrent Neural Network Architectures for De Novo Drug Design
Abstract
In drug discovery, Deep Learning algorithms are emerging as a potential method to generate novel chemical structures since they can speed up the traditional process and decrease expenditure. Recurrent architectures are amongst the most promising methods for computational de novo drug design. One current challenge consists in finding the optimal architecture and parameters for the recurrent network...
Year
DOI
Venue
2021
10.1109/CBMS52027.2021.00067
2021 IEEE 34th International Symposium on Computer-Based Medical Systems (CBMS)
Keywords
DocType
ISBN
Drugs,Recurrent neural networks,Biological system modeling,Computer architecture,Syntactics,Encoding,Libraries
Conference
978-1-6654-4121-6
Citations 
PageRank 
References 
0
0.34
0
Authors
5
Name
Order
Citations
PageRank
Beatriz P. Santos100.34
Maryam Abbasi200.34
Tiago L. Pereira362.51
Bernardete Ribeiro400.34
Joel P. Arrais501.35