Daniel Seeliger

According to our database, Daniel Seeliger authored at least 7 papers between 2009 and 2020.

Collaborative distances:

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

2020

BIreactive: A Machine-Learning Model to Estimate Covalent Warhead Reactivity.

Ferruccio Palazzesi, Markus R. Hermann, Marc A. Grundl, Alexander Pautsch, Daniel Seeliger, Christofer S. Tautermann, Alexander Weber

J. Chem. Inf. Model., 2020

2015

pmx: Automated protein structure and topology generation for alchemical perturbations.

Vytautas Gapsys, Servaas Michielssens, Daniel Seeliger, Bert L. de Groot

J. Comput. Chem., 2015

The impact of data integrity on decision making in early lead discovery.

Bernd Beck, Daniel Seeliger, Jan M. Kriegl

J. Comput. Aided Mol. Des., 2015

2014

Computational Method To Identify Druggable Binding Sites That Target Protein-Protein Interactions.

Hubert Li, Vinod Kasam, Christofer S. Tautermann, Daniel Seeliger, Nagarajan Vaidehi

J. Chem. Inf. Model., 2014

2010

Conformational Transitions upon Ligand Binding: Holo-Structure Prediction from Apo Conformations.

Daniel Seeliger, Bert L. de Groot

PLoS Comput. Biol., 2010

Ligand docking and binding site analysis with PyMOL and Autodock/Vina.

Daniel Seeliger, Bert L. de Groot

J. Comput. Aided Mol. Des., 2010

2009

tCONCOORD-GUI: Visually supported conformational sampling of bioactive molecules.

Daniel Seeliger, Bert L. de Groot

J. Comput. Chem., 2009