Daniel Seeliger

Publication Activity (10 Years)

Years Active: 2009-2020
Publications (10 Years): 3

Top Topics

Protein Structural

Computational Approaches

Top Venues

J. Chem. Inf. Model.

J. Comput. Chem.

J. Comput. Aided Mol. Des.

Publications

Ferruccio Palazzesi, Markus R. Hermann, Marc A. Grundl, Alexander Pautsch, Daniel Seeliger, Christofer S. Tautermann, Alexander Weber
BIreactive: A Machine-Learning Model to Estimate Covalent Warhead Reactivity. J. Chem. Inf. Model. 60 (6) (2020)
Bernd Beck, Daniel Seeliger, Jan M. Kriegl
The impact of data integrity on decision making in early lead discovery. J. Comput. Aided Mol. Des. 29 (9) (2015)
Vytautas Gapsys, Servaas Michielssens, Daniel Seeliger, Bert L. de Groot
pmx: Automated protein structure and topology generation for alchemical perturbations. J. Comput. Chem. 36 (5) (2015)
Hubert Li, Vinod Kasam, Christofer S. Tautermann, Daniel Seeliger, Nagarajan Vaidehi
Computational Method To Identify Druggable Binding Sites That Target Protein-Protein Interactions. J. Chem. Inf. Model. 54 (5) (2014)
Daniel Seeliger, Bert L. de Groot
Conformational Transitions upon Ligand Binding: Holo-Structure Prediction from Apo Conformations. PLoS Comput. Biol. 6 (1) (2010)
Daniel Seeliger, Bert L. de Groot
Ligand docking and binding site analysis with PyMOL and Autodock/Vina. J. Comput. Aided Mol. Des. 24 (5) (2010)
Daniel Seeliger, Bert L. de Groot
tCONCOORD-GUI: Visually supported conformational sampling of bioactive molecules. J. Comput. Chem. 30 (7) (2009)