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2004.00979
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Large-scale ligand-based virtual screening for SARS-CoV-2 inhibitors using deep neural networks
25 March 2020
M. Hofmarcher
Andreas Mayr
Elisabeth Rumetshofer
Peter Ruch
Philipp Renz
Johannes Schimunek
Philipp Seidl
Andreu Vall
Michael Widrich
Sepp Hochreiter
G. Klambauer
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Papers citing
"Large-scale ligand-based virtual screening for SARS-CoV-2 inhibitors using deep neural networks"
5 / 5 papers shown
Title
Automatic design of novel potential 3CL
pro
^{\text{pro}}
pro
and PL
pro
^{\text{pro}}
pro
inhibitors
Timothy James Atkinson
Saeed Saremi
Faustino J. Gomez
Jonathan Masci
AI4CE
20
0
0
28 Jan 2021
A Survey on Applications of Artificial Intelligence in Fighting Against COVID-19
Jianguo Chen
KenLi Li
Zhaolei Zhang
Keqin Li
Philip S. Yu
35
101
0
04 Jul 2020
One-shot screening of potential peptide ligands on HR1 domain in COVID-19 glycosylated spike (S) protein with deep siamese network
N. Savioli
19
10
0
05 Apr 2020
Mapping the Landscape of Artificial Intelligence Applications against COVID-19
Joseph Aylett-Bullock
A. Luccioni
K. H. Pham
C. Lam
M. Luengo-Oroz
AI4CE
39
406
0
25 Mar 2020
MoleculeNet: A Benchmark for Molecular Machine Learning
Zhenqin Wu
Bharath Ramsundar
Evan N. Feinberg
Joseph Gomes
C. Geniesse
Aneesh S. Pappu
K. Leswing
Vijay S. Pande
OOD
216
1,780
0
02 Mar 2017
1