Christoph Riplinger

Publication Activity (10 Years)

Years Active: 2017-2023
Publications (10 Years): 4

Top Topics

Quantum Mechanics

Human Decision Making

Interaction Networks

Top Venues

J. Comput. Chem.

J. Comput. Aided Mol. Des.

Publications

Róbert Izsák, Christoph Riplinger, Nick S. Blunt, Bernardo de Souza, Nicole Holzmann, Ophelia Crawford, Joan Camps, Frank Neese, Patrick Schopf
Quantum computing in pharma: A multilayer embedding approach for near future applications. J. Comput. Chem. 44 (3) (2023)
Michael Edmund Beck, Christoph Riplinger, Frank Neese, Giovanni Bistoni
Unraveling individual host-guest interactions in molecular recognition from first principles quantum mechanics: Insights into the nature of nicotinic acetylcholine receptor agonist binding. J. Comput. Chem. 42 (5) (2021)
Michael Edmund Beck, Jacopo Negroni, Svend Matthiesen, Michael Kohnen, Christoph Riplinger
A binding mode hypothesis for prothioconazole binding to CYP51 derived from first principles quantum chemistry. J. Comput. Aided Mol. Des. 35 (4) (2021)
Octav Caldararu, Martin A. Olsson, Christoph Riplinger, Frank Neese, Ulf Ryde
Binding free energies in the SAMPL5 octa-acid host-guest challenge calculated with DFT-D3 and CCSD(T). J. Comput. Aided Mol. Des. 31 (1) (2017)