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Generative Models for Automatic Chemical Design

Generative Models for Automatic Chemical Design

2 July 2019
Daniel Schwalbe-Koda
Rafael Gómez-Bombarelli
    MedIm
    AI4CE
ArXivPDFHTML

Papers citing "Generative Models for Automatic Chemical Design"

7 / 7 papers shown
Title
Autonomous discovery in the chemical sciences part II: Outlook
Autonomous discovery in the chemical sciences part II: Outlook
Connor W. Coley
Natalie S. Eyke
K. Jensen
8
171
0
30 Mar 2020
Molecular Sets (MOSES): A Benchmarking Platform for Molecular Generation
  Models
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
151
628
0
29 Nov 2018
Conditional molecular design with deep generative models
Conditional molecular design with deep generative models
Seokho Kang
Kyunghyun Cho
BDL
138
182
0
30 Apr 2018
Junction Tree Variational Autoencoder for Molecular Graph Generation
Junction Tree Variational Autoencoder for Molecular Graph Generation
Wengong Jin
Regina Barzilay
Tommi Jaakkola
208
1,205
0
12 Feb 2018
Constrained Bayesian Optimization for Automatic Chemical Design
Constrained Bayesian Optimization for Automatic Chemical Design
Ryan-Rhys Griffiths
José Miguel Hernández-Lobato
BDL
26
75
0
16 Sep 2017
Conditional Image Synthesis With Auxiliary Classifier GANs
Conditional Image Synthesis With Auxiliary Classifier GANs
Augustus Odena
C. Olah
Jonathon Shlens
GAN
224
3,174
0
30 Oct 2016
Pixel Recurrent Neural Networks
Pixel Recurrent Neural Networks
Aaron van den Oord
Nal Kalchbrenner
Koray Kavukcuoglu
SSeg
GAN
219
2,391
0
25 Jan 2016
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