Ulrich Kleinekathöfer
Orcid: 0000-0002-6114-7431
According to our database1,
Ulrich Kleinekathöfer
authored at least 7 papers
between 2010 and 2024.
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Collaborative distances:
Timeline
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Bibliography
2024
Evaluation of uncertainty estimations for Gaussian process regression based machine learning interatomic potentials.
CoRR, 2024
Spectral Densities, Structured Noise and Ensemble Averaging within Open Quantum Dynamics.
CoRR, 2024
2023
Conformational Dynamics of Loop L3 in OmpF: Implications toward Antibiotic Translocation and Voltage Gating.
J. Chem. Inf. Model., February, 2023
2020
Flexible Fitting of Small Molecules into Electron Microscopy Maps Using Molecular Dynamics Simulations with Neural Network Potentials.
J. Chem. Inf. Model., 2020
Computational Modeling of Ion Transport in Bulk and through a Nanopore Using the Drude Polarizable Force Field.
J. Chem. Inf. Model., 2020
2010
Functional Rotation of the Transporter AcrB: Insights into Drug Extrusion from Simulations.
PLoS Comput. Biol., 2010