Details
Title
Dömer, Manuel
Sciper ID
188574
Publications
Approaches to Increase the Accuracy of Molecular Dynamics Simulations
Assessing the performance of computational methods for the prediction of the ground state structure of a cyclic decapeptide
Cold Ion Spectroscopy Reveals the Intrinsic Structure of a Decapeptide
Generalized QM/MM Force Matching Approach Applied to the 11-cis Protonated Schiff Base Chromophore of Rhodopsin
In situ parameterisation of SCC-DFTB repulsive potentials by iterative Boltzmann inversion
Intricacies of Describing Weak Interactions involving Halogen Atoms within Density Functional Theory
Photodynamics of Lys+-Trp Protein Motifs: Hydrogen Bonds Ensure Photostability
Pushing the Frontiers of First-Principles Based Computer Simulations of Chemical and Biological Systems
Revealing the Structure of Tryptophan in Microhydrated Complexes by Cold Ion Spectroscopy
Solvent rearrangements during the transition from hydrophilic to hydrophobic solvation
Assessing the performance of computational methods for the prediction of the ground state structure of a cyclic decapeptide
Cold Ion Spectroscopy Reveals the Intrinsic Structure of a Decapeptide
Generalized QM/MM Force Matching Approach Applied to the 11-cis Protonated Schiff Base Chromophore of Rhodopsin
In situ parameterisation of SCC-DFTB repulsive potentials by iterative Boltzmann inversion
Intricacies of Describing Weak Interactions involving Halogen Atoms within Density Functional Theory
Photodynamics of Lys+-Trp Protein Motifs: Hydrogen Bonds Ensure Photostability
Pushing the Frontiers of First-Principles Based Computer Simulations of Chemical and Biological Systems
Revealing the Structure of Tryptophan in Microhydrated Complexes by Cold Ion Spectroscopy
Solvent rearrangements during the transition from hydrophilic to hydrophobic solvation
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Doemer, Manuel
Doemer, M.
Doemer, M.
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