Jens Carlsson

According to our database, Jens Carlsson authored at least 6 papers between 2013 and 2021.

Collaborative distances:

• Dijkstra number of five.
• Erdős number of five.

2021

Can molecular dynamics simulations improve the structural accuracy and virtual screening performance of GPCR models?

Jon Kapla, Ismael Rodriguez-Espigares, Flavio Ballante, Jana Selent, Jens Carlsson

PLoS Comput. Biol., 2021

2020

Performance of virtual screening against GPCR homology models: Impact of template selection and treatment of binding site plasticity.

Mariama Jaiteh, Ismael Rodriguez-Espigares, Jana Selent, Jens Carlsson

PLoS Comput. Biol., 2020

2018

Prediction of Ordered Water Molecules in Protein Binding Sites from Molecular Dynamics Simulations: The Impact of Ligand Binding on Hydration Networks.

Axel Rudling, Adolfo Orro, Jens Carlsson

J. Chem. Inf. Model., 2018

2015

Molecular Docking Screening Using Agonist-Bound GPCR Structures: Probing the A_2A Adenosine Receptor.

David Rodríguez, Zhang-Guo Gao, Steven M. Moss, Kenneth A. Jacobson, Jens Carlsson

J. Chem. Inf. Model., 2015

2014

Strategies for Improved Modeling of GPCR-Drug Complexes: Blind Predictions of Serotonin Receptors Bound to Ergotamine.

David Rodríguez, Anirudh Ranganathan, Jens Carlsson

J. Chem. Inf. Model., 2014

2013

Complementarity between in Silico and Biophysical Screening Approaches in Fragment-Based Lead Discovery against the A_2A Adenosine Receptor.

Dan Chen, Anirudh Ranganathan, Adriaan P. IJzerman, Gregg Siegal, Jens Carlsson

J. Chem. Inf. Model., 2013