Jan Walther Perthold
7PUBLICATIONS
17CO-AUTHORS
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Publications (7)
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|Jan 02, 2024
Guidelines for Free-Energy Calculations Involving Charge Changes.Drazen Petrov, Jan Walther Perthold, Chris Oostenbrink
|Dec 20, 2021
Structure-guided glyco-engineering of ACE2 for improved potency as soluble SARS-CoV-2 decoy receptor.Tümay Capraz, Nikolaus F Kienzl, Elisabeth Laurent
|Nov 02, 2020
Charge-Changing Perturbations and Path Sampling via Classical Molecular Dynamic Simulations of Simple Guest-Host Systems.Christoph Öhlknecht, Jan Walther Perthold, Bettina Lier
|Jun 04, 2020
Toward Automated Free Energy Calculation with Accelerated Enveloping Distribution Sampling (A-EDS).Jan Walther Perthold, Dražen Petrov, Chris Oostenbrink
|Dec 03, 2019
GroScore: Accurate Scoring of Protein-Protein Binding Poses Using Explicit-Solvent Free-Energy Calculations.Jan Walther Perthold, Chris Oostenbrink
|Apr 20, 2018
Accelerated Enveloping Distribution Sampling: Enabling Sampling of Multiple End States while Preserving Local Energy Minima.Jan Walther Perthold, Chris Oostenbrink
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Frequent Collaborators
7 joint publications
Chris Oostenbrink
1 joint publications
Tümay Capraz
1 joint publications
Nikolaus F Kienzl
1 joint publications
Elisabeth Laurent
1 joint publications
Esther Föderl-Höbenreich
1 joint publications
Clemens Grünwald-Gruber
1 joint publications
Vanessa Monteil
1 joint publications
Gerald Wirnsberger
1 joint publications
Kurt Zatloukal
1 joint publications
Lukas Mach
