Atanas Patronov

Publication Activity (10 Years)

Years Active: 2020-2022
Publications (10 Years): 10

Top Topics

Protein Interaction

Carefully Chosen

Top Venues

J. Cheminformatics

J. Chem. Inf. Model.

Nat. Mach. Intell.

Publications

Jeff Guo, Vendy Fialková, Juan Diego Arango, Christian Margreitter, Jon Paul Janet, Kostas Papadopoulos, Ola Engkvist, Atanas Patronov
Improving de novo molecular design with curriculum learning. Nat. Mach. Intell. 4 (6) (2022)
Jeff Guo, Vendy Fialková, Juan Diego Arango, Christian Margreitter, Jon Paul Janet, Kostas Papadopoulos, Ola Engkvist, Atanas Patronov
Author Correction: Improving de novo molecular design with curriculum learning. Nat. Mach. Intell. 4 (8) (2022)
Jiazhen He, Eva Nittinger, Christian Tyrchan, Werngard Czechtizky, Atanas Patronov, Esben Jannik Bjerrum, Ola Engkvist
Transformer-based molecular optimization beyond matched molecular pairs. J. Cheminformatics 14 (1) (2022)
Iiris Sundin, Alexey Voronov, Haoping Xiao, Kostas Papadopoulos, Esben Jannik Bjerrum, Markus Heinonen, Atanas Patronov, Samuel Kaski, Ola Engkvist
Human-in-the-loop assisted de novo molecular design. J. Cheminformatics 14 (1) (2022)
Vendy Fialková, Jiaxi Zhao, Kostas Papadopoulos, Ola Engkvist, Esben Jannik Bjerrum, Thierry Kogej, Atanas Patronov
Library Design. J. Chem. Inf. Model. 62 (9) (2022)
Penglei Wang, Shuangjia Zheng, Yize Jiang, Chengtao Li, Junhong Liu, Chang Wen, Atanas Patronov, Dahong Qian, Hongming Chen, Yuedong Yang
Structure-Aware Multimodal Deep Learning for Drug-Protein Interaction Prediction. J. Chem. Inf. Model. 62 (5) (2022)
J. Harry Moore, Matthias R. Bauer, Jeff Guo, Atanas Patronov, Ola Engkvist, Christian Margreitter
generated small molecules. Bioinform. 38 (21) (2022)
Jeff Guo, Jon Paul Janet, Matthias R. Bauer, Eva Nittinger, Kathryn A. Giblin, Kostas Papadopoulos, Alexey Voronov, Atanas Patronov, Ola Engkvist, Christian Margreitter
DockStream: a docking wrapper to enhance de novo molecular design. J. Cheminformatics 13 (1) (2021)
Josep Arús-Pous, Atanas Patronov, Esben Jannik Bjerrum, Christian Tyrchan, Jean-Louis Reymond, Hongming Chen, Ola Engkvist
SMILES-based deep generative scaffold decorator for de-novo drug design. J. Cheminformatics 12 (1) (2020)
Thomas Blaschke, Josep Arús-Pous, Hongming Chen, Christian Margreitter, Christian Tyrchan, Ola Engkvist, Kostas Papadopoulos, Atanas Patronov
REINVENT 2.0: An AI Tool for De Novo Drug Design. J. Chem. Inf. Model. 60 (12) (2020)