Tim ten Brink

Publication Activity (10 Years)

Years Active: 2009-2015
Publications (10 Years): 2

Top Topics

Chemical Reaction

Scoring Function

Top Venues

J. Cheminformatics

J. Chem. Inf. Model.

J. Comput. Aided Mol. Des.

Publications

Tim ten Brink, Clementine Aguirre, Thomas E. Exner, Isabelle Krimm
Performance of Protein-Ligand Docking with Simulated Chemical Shift Perturbations. J. Chem. Inf. Model. 55 (2) (2015)
Ionut Onila, Tim ten Brink, Kai Fredriksson, Luca Codutti, Adam Mazur, Christian Griesinger, Teresa Carlomagno, Thomas E. Exner
On-the-Fly Integration of Data from a Spin-Diffusion-Based NMR Experiment into Protein-Ligand Docking. J. Chem. Inf. Model. 55 (9) (2015)
Tim ten Brink, Clementine Aguirre, Isabelle Krimm
Fragment docking supported by NMR shift perturbations. J. Cheminformatics 6 (S-1) (2014)
Oliver Korb, Tim ten Brink, Fredrick Robin Devadoss, Victor Paul Raj, Matthias Keil, Thomas E. Exner
Are predefined decoy sets of ligand poses able to quantify scoring function accuracy? J. Comput. Aided Mol. Des. 26 (2) (2012)
Tim ten Brink, Ionut Onila, Adam Mazur, Oliver Korb, Heiko M. Möller, Christian Griesinger, Teresa Carlomagno, Thomas E. Exner
Guiding protein-ligand docking with different experimental NMR-data. J. Cheminformatics 4 (S-1) (2012)
Tim ten Brink, Thomas E. Exner
A combined combinatorial and pKa-based approach to ligand protonation states. J. Cheminformatics 2 (S-1) (2010)
Tim ten Brink, Thomas E. Exner
based protonation states and microspecies for protein-ligand docking. J. Comput. Aided Mol. Des. 24 (11) (2010)
Tim ten Brink, Thomas E. Exner
Influence of Protonation, Tautomeric, and Stereoisomeric States on Protein-Ligand Docking Results. J. Chem. Inf. Model. 49 (6) (2009)