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2004.01215
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CogMol: Target-Specific and Selective Drug Design for COVID-19 Using Deep Generative Models
2 April 2020
Vijil Chenthamarakshan
Payel Das
Samuel C. Hoffman
Hendrik Strobelt
Inkit Padhi
Kar Wai Lim
Benjamin Hoover
Matteo Manica
Jannis Born
Teodoro Laino
Aleksandra Mojsilović
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Papers citing
"CogMol: Target-Specific and Selective Drug Design for COVID-19 Using Deep Generative Models"
8 / 8 papers shown
Title
Molecular Sets (MOSES): A Benchmarking Platform for Molecular Generation Models
Daniil Polykovskiy
Alexander Zhebrak
Benjamín Sánchez-Lengeling
Sergey Golovanov
Oktai Tatanov
...
Simon Johansson
Hongming Chen
Sergey I. Nikolenko
Alán Aspuru-Guzik
Alex Zhavoronkov
ELM
228
644
0
29 Nov 2018
Syntax-Directed Variational Autoencoder for Structured Data
H. Dai
Yingtao Tian
Bo Dai
Steven Skiena
Le Song
74
324
0
24 Feb 2018
Junction Tree Variational Autoencoder for Molecular Graph Generation
Wengong Jin
Regina Barzilay
Tommi Jaakkola
286
1,358
0
12 Feb 2018
GraphVAE: Towards Generation of Small Graphs Using Variational Autoencoders
M. Simonovsky
N. Komodakis
GNN
BDL
81
842
0
09 Feb 2018
Application of generative autoencoder in de novo molecular design
T. Blaschke
Marcus Olivecrona
Ola Engkvist
J. Bajorath
Hongming Chen
AI4CE
80
343
0
21 Nov 2017
Objective-Reinforced Generative Adversarial Networks (ORGAN) for Sequence Generation Models
G. L. Guimaraes
Benjamín Sánchez-Lengeling
Carlos Outeiral
Pedro Luis Cunha Farias
Alán Aspuru-Guzik
GAN
62
523
0
30 May 2017
Molecular De Novo Design through Deep Reinforcement Learning
Marcus Olivecrona
T. Blaschke
Ola Engkvist
Hongming Chen
BDL
92
1,003
0
25 Apr 2017
Automatic chemical design using a data-driven continuous representation of molecules
Rafael Gómez-Bombarelli
Jennifer N. Wei
David Duvenaud
José Miguel Hernández-Lobato
Benjamín Sánchez-Lengeling
Dennis Sheberla
J. Aguilera-Iparraguirre
Timothy D. Hirzel
Ryan P. Adams
Alán Aspuru-Guzik
3DV
114
2,911
0
07 Oct 2016
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