Wehmeyer, Christoph Sebastian 1979-
Christoph Wehmeyer
VIAF ID: 305178421 (Personal)
Permalink: http://viaf.org/viaf/305178421
Preferred Forms
4xx's: Alternate Name Forms (4)
5xx's: Related Names (1)
Works
Title | Sources |
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A Coupled Molecular Dynamics/Kinetic Monte Carlo Approach for Protonation Dynamics in Extended Systems. | |
Foraging on the potential energy surface: a swarm intelligence-based optimizer for molecular geometry. | |
MHC class II complexes sample intermediate states along the peptide exchange pathway. | |
Multiensemble Markov models of molecular thermodynamics and kinetics. | |
Proton conduction via large-scale atomistic simulations | |
Protonenleitung mittels großskaliger atomistischer Simulationen | |
PyEMMA 2: A Software Package for Estimation, Validation, and Analysis of Markov Models. | |
Specific quantum mechanical/molecular mechanical capping-potentials for biomolecular functional groups. | |
The structure and IR signatures of the arginine-glutamate salt bridge. Insights from the classical MD simulations. | |
Time-lagged autoencoders: Deep learning of slow collective variables for molecular kinetics | |
Water-Free Proton Conduction in Hexakis(p-Phosphonatophenyl)benzene Nanochannels |