Jonas Boström

17 papers Misc 1Journal 16

Year	Rank	Type	Title / Venue / Authors
2022	J	`jnl`	On the Value of Using 3D Shape and Electrostatic Similarities in Deep Generative Methods. J. Chem. Inf. Model. Giovanni Bolcato, Esther Heid, Jonas Boström
2021	J	`jnl`	Reusability report: Learning the language of synthetic methods used in medicinal chemistry. Nat. Mach. Intell. Jon Paul Janet, Anna Tomberg, Jonas Boström
2021	J	`jnl`	Transformers for future medicinal chemists. Nat. Mach. Intell. Jonas Boström
2019	J	`jnl`	Deep Convolutional Neural Networks for the Prediction of Molecular Properties: Challenges and Opportunities Connected to the Data. J. Integr. Bioinform. Niclas Ståhl, Göran Falkman, Alexander Karlsson, Gunnar Mathiason, Jonas Boström
2019	J	`jnl`	Deep Reinforcement Learning for Multiparameter Optimization in de novo Drug Design. J. Chem. Inf. Model. Niclas Ståhl, Göran Falkman, Alexander Karlsson, Gunnar Mathiason, Jonas Boström
2018	Misc	`conf`	Improving the Use of Deep Convolutional Neural Networks for the Prediction of Molecular Properties. PACBB Niclas Ståhl, Göran Falkman, Alexander Karlsson, Gunnar Mathiason, Jonas Boström
2017	J	`jnl`	Discovery and Evaluation of Anti-Fibrinolytic Plasmin Inhibitors Derived from 5-(4-Piperidyl)isoxazol-3-ol (4-PIOL). J. Chem. Inf. Model. Thomas C. Schmidt, Per-Olof Eriksson, David Gustafsson, David Cosgrove, Bente Frølund, Jonas Boström
2015	J	`jnl`	Molecular Rift: Virtual Reality for Drug Designers. J. Chem. Inf. Model. Magnus Norrby, Christoph Grebner, Joakim Eriksson, Jonas Boström
2014	J	`jnl`	What compound should I make next? Using Matched Molecular Series for prospective medicinal chemistry. J. Cheminformatics Noel M. O'Boyle, Roger A. Sayle, Jonas Boström
2013	J	`jnl`	A new module for constrained multi-fragment geometry optimization in internal coordinates implemented in the MOLCAS package. J. Comput. Chem. Victor Vysotskiy, Jonas Boström, Valera Veryazov
2012	J	`jnl`	Exploiting Structural Information in Patent Specifications for Key Compound Prediction. J. Chem. Inf. Model. Christian Tyrchan, Jonas Boström, Fabrizio Giordanetto, Jon Winter, Sorel Muresan
2010	J	`jnl`	A NEMO potential that includes the dipole-quadrupole and quadrupole-quadrupole polarizability. J. Comput. Chem. Asbjørn Holt, Jonas Boström, Gunnar Karlström, Roland Lindh
2006	J	`jnl`	MIMUMBA Revisited: Torsion Angle Rules for Conformer Generation Derived from X-ray Structures. J. Chem. Inf. Model. Jens Sadowski, Jonas Boström
2003	J	`jnl`	A 3D QSAR Study on a Set of Dopamine D J. Chem. Inf. Comput. Sci. Jonas Boström, Markus Böhm, Klaus Gundertofte, Gerhard Klebe
2001	J	`jnl`	Reproducing the conformations of protein-bound ligands: A critical evaluation of several popular conformational searching tools. J. Comput. Aided Mol. Des. Jonas Boström
2000	J	`jnl`	A pharmacophore model for dopamine D4 receptor antagonists. J. Comput. Aided Mol. Des. Jonas Boström, Klaus Gundertofte, Tommy Liljefors
1998	J	`jnl`	Conformational energy penalties of protein-bound ligands. J. Comput. Aided Mol. Des. Jonas Boström, Per-Ola Norrby, Tommy Liljefors