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Angewandte Chemie (International Ed. in English)
|
September 28, 2020
A Potent and Selective Janus Kinase Inhibitor with a Chiral 3D-Shaped Triquinazine Ring System from Chemical Space
Kris Meier, Josep Arús-Pous, Jean-Louis Reymond
Chimia
|
April 26, 2020
The Generated Databases (GDBs) as a Source of 3D-shaped Building Blocks for Use in Medicinal Chemistry and Drug Discovery
Kris Meier, Sven Bühlmann, Josep Arús-Pous, et al.
Journal of Chemical Information and Modeling
|
October 12, 2017
Virtual Exploration of the Ring Systems Chemical Universe
Ricardo Visini, Josep Arús-Pous, Mahendra Awale, et al.
Chimia
|
December 30, 2019
Exploring Chemical Space with Machine Learning
Josep Arús-Pous, Mahendra Awale, Daniel Probst, et al.
Chimia
|
October 27, 2017
Chemical Space: Big Data Challenge for Molecular Diversity
Mahendra Awale, Ricardo Visini, Daniel Probst, et al.
Journal of Cheminformatics
|
March 15, 2019
Exploring the GDB-13 chemical space using deep generative models
Josep Arús-Pous, Thomas Blaschke, Silas Ulander, et al.
Journal of Chemical Information and Modeling
|
October 29, 2020
REINVENT 2.0: An AI Tool for De Novo Drug Design
Thomas Blaschke, Josep Arús-Pous, Hongming Chen, et al.
Journal of Cheminformatics
|
January 12, 2021
SMILES-based deep generative scaffold decorator for de-novo drug design
Josep Arús-Pous, Atanas Patronov, Esben Jannik Bjerrum, et al.
Journal of Cheminformatics
|
January 12, 2021
A de novo molecular generation method using latent vector based generative adversarial network
Oleksii Prykhodko, Simon Viet Johansson, Panagiotis-Christos Kotsias, et al.
Journal of Cheminformatics
|
January 12, 2021
Randomized SMILES strings improve the quality of molecular generative models
Josep Arús-Pous, Simon Viet Johansson, Oleksii Prykhodko, et al.
Page
of 2
Search research articles
Search
Showing results (1-10 of 12) with videos related to
Sort By:
Page
of 2
Angewandte Chemie (International Ed. in English)
|
September 28, 2020
A Potent and Selective Janus Kinase Inhibitor with a Chiral 3D-Shaped Triquinazine Ring System from Chemical Space
Kris Meier, Josep Arús-Pous, Jean-Louis Reymond
Chimia
|
April 26, 2020
The Generated Databases (GDBs) as a Source of 3D-shaped Building Blocks for Use in Medicinal Chemistry and Drug Discovery
Kris Meier, Sven Bühlmann, Josep Arús-Pous, et al.
Journal of Chemical Information and Modeling
|
October 12, 2017
Virtual Exploration of the Ring Systems Chemical Universe
Ricardo Visini, Josep Arús-Pous, Mahendra Awale, et al.
Chimia
|
December 30, 2019
Exploring Chemical Space with Machine Learning
Josep Arús-Pous, Mahendra Awale, Daniel Probst, et al.
Chimia
|
October 27, 2017
Chemical Space: Big Data Challenge for Molecular Diversity
Mahendra Awale, Ricardo Visini, Daniel Probst, et al.
Journal of Cheminformatics
|
March 15, 2019
Exploring the GDB-13 chemical space using deep generative models
Josep Arús-Pous, Thomas Blaschke, Silas Ulander, et al.
Journal of Chemical Information and Modeling
|
October 29, 2020
REINVENT 2.0: An AI Tool for De Novo Drug Design
Thomas Blaschke, Josep Arús-Pous, Hongming Chen, et al.
Journal of Cheminformatics
|
January 12, 2021
SMILES-based deep generative scaffold decorator for de-novo drug design
Josep Arús-Pous, Atanas Patronov, Esben Jannik Bjerrum, et al.
Journal of Cheminformatics
|
January 12, 2021
A de novo molecular generation method using latent vector based generative adversarial network
Oleksii Prykhodko, Simon Viet Johansson, Panagiotis-Christos Kotsias, et al.
Journal of Cheminformatics
|
January 12, 2021
Randomized SMILES strings improve the quality of molecular generative models
Josep Arús-Pous, Simon Viet Johansson, Oleksii Prykhodko, et al.
Page
of 2