Concepedia

Daniel Seeliger

DS

38

Publications

5.1K

Citations

28

H-Index

2004

Active since

Affiliations

Boehringer Ingelheim (Germany)(Current)

Max Planck Institute for Biophysical Chemistry

Max Planck Society

University of Applied Sciences Biberach

Forschungszentrum Jülich

Daniel Seeliger is an author at Boehringer Ingelheim (Germany) specializing in medicine, molecular biology, and biophysics.

Top concepts

MedicineMolecular BiologyBiophysicsEngineeringProtein FoldingBiochemistryNatural SciencesMolecular DockingProtein EngineeringDrug Discovery

Publications per year

2004–2022

38

Publications

38

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

Daniel Seeliger, Bert L. de Groot · Journal of Computer-Aided Molecular Design · 2010 · 2.4K citations · Full text

pmx: Automated protein structure and topology generation for alchemical perturbations

Vytautas Gapsys, Servaas Michielssens, Daniel Seeliger et al. · Journal of Computational Chemistry · 2014 · 288 citations · Full text

Engineering, Protein Assembly, Biomolecular Structure Prediction +18

Large scale relative protein ligand binding affinities using non-equilibrium alchemy

Vytautas Gapsys, Laura Pérez‐Benito, Matteo Aldeghi et al. · Chemical Science · 2019 · 285 citations · Full text

Protein Thermostability Calculations Using Alchemical Free Energy Simulations

Daniel Seeliger, Bert L. de Groot · Biophysical Journal · 2010 · 235 citations · Full text

Protein Chemistry, Biochemistry, Protein Folding +5

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

Daniel Seeliger, Bert L. de Groot · PLoS Computational Biology · 2010 · 156 citations · Full text

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