Bettina G. Keller

Bettina G. Keller's AcademicInfluence.com Rankings

Bettina G. Keller

Chemistry

#5515

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#6710

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chemistry Degrees

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Chemistry

Bettina G. Keller's Degrees

PhD Chemistry University of Zurich

Why Is Bettina G. Keller Influential?

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According to Wikipedia, Bettina G. Keller is a professor for Theoretical Chemistry at Freie Universität Berlin. Life and education Keller did her Abitur at the Remstal-Gymnasium Weinstadt in 2000. In October 2000, she started her diploma studies at University of Karlsruhe, Germany. In 2002, she continued her diploma studies at ETH Zürich. She received her diploma in 2005. The title of her diploma thesis was "Estimating the absolute entropy of a liquid based on a single molecular dynamics simulation under periodic boundary conditions." In 2005, she started her PhD studies in Chemistry at ETH Zürich. She finished her PhD thesis "Algorithms for the Analysis of Biomolecular Simulations: Ensemble Averages, Marginal Distributions, Clustering, and Markov Models" in the group of Wilfred F. van Gunsteren in 2009. From January 2010 to July 2010, she was a visiting lecturer at CECAM Node "Scientific Computing in the Molecular Sciences" at Freie Universität Berlin. From July 2010 to September 2013, she was a postdoctoral researcher at Freie Universität Berlin. From October 2013 to September 2019, she was a junior professor for Theoretical Chemistry at Freie Universität Berlin. Since September 2019, she is a professor for Theoretical Chemistry at Freie Universität Berlin.

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Bettina G. Keller's Published Works

Number of citations in a given year to any of this author's works

Total number of citations to an author for the works they published in a given year. This highlights publication of the most important work(s) by the author

Published Works

Markov models of molecular kinetics: generation and validation. (2011) (924)
Variational Approach to Molecular Kinetics. (2014) (235)
Comparing geometric and kinetic cluster algorithms for molecular simulation data. (2010) (108)
Probing molecular kinetics with Markov models: metastable states, transition pathways and spectroscopic observables. (2011) (98)
Complex RNA Folding Kinetics Revealed by Single-Molecule FRET and Hidden Markov Models (2014) (85)
Kinetic Models of Cyclosporin A in Polar and Apolar Environments Reveal Multiple Congruent Conformational States (2016) (72)
Dynamic properties of force fields. (2015) (70)
Markov models and dynamical fingerprints: Unraveling the complexity of molecular kinetics (2012) (54)
Density-based cluster algorithms for the identification of core sets. (2016) (50)
Girsanov reweighting for metadynamics simulations. (2018) (40)
Rationalization of the Membrane Permeability Differences in a Series of Analogue Cyclic Decapeptides (2018) (37)
Interconversion Rates between Conformational States as Rationale for the Membrane Permeability of Cyclosporines. (2017) (35)
Computational close up on protein–protein interactions: how to unravel the invisible using molecular dynamics simulations? (2015) (35)
Single-molecule FRET reveals the energy landscape of the full-length SAM-I riboswitch. (2017) (34)
Intradomain Allosteric Network Modulates Calcium Affinity of the C-Type Lectin Receptor Langerin. (2016) (32)
Girsanov reweighting for path ensembles and Markov state models. (2017) (29)
An Analysis of the Validity of Markov State Models for Emulating the Dynamics of Classical Molecular Systems and Ensembles. (2011) (27)
Bayesian hidden Markov model analysis of single-molecule force spectroscopy: Characterizing kinetics under measurement uncertainty (2011) (26)
A Basis Set for Peptides for the Variational Approach to Conformational Kinetics. (2015) (23)
Biomolecular structure refinement based on adaptive restraints using local-elevation simulation (2007) (23)
Allostery in C-type lectins. (2019) (18)
Common Nearest Neighbor Clustering - A Benchmark (2018) (18)
Total Synthesis of the Death Cap Toxin Phalloidin: Atropoisomer Selectivity Explained by Molecular-Dynamics Simulations. (2019) (15)
Dynamical reweighting methods for Markov models. (2019) (15)
Estimation of the infinitesimal generator by square-root approximation (2017) (15)
On using oscillating time-dependent restraints in MD simulation (2007) (15)
Multiply Intercalator-Substituted Cu(II) Cyclen Complexes as DNA Condensers and DNA/RNA Synthesis Inhibitors. (2018) (14)
What stabilizes the 314‐helix in β3‐peptides? A conformational analysis using molecular simulation (2010) (14)
Molecular dynamics simulations data of the twenty encoded amino acids in different force fields (2016) (13)
Path probability ratios for Langevin dynamics-Exact and approximate. (2020) (9)
Exploring Rigid and Flexible Core Trivalent Sialosides for Influenza Virus Inhibition (2018) (8)
Markov models from the square root approximation of the Fokker–Planck equation: calculating the grid-dependent flux (2020) (6)
The vibrational spectrum of the hydrated alanine-leucine peptide in the amide region from IR experiments and first principles calculations (2018) (6)
The molecular basis for the pH-dependent calcium affinity of the pattern recognition receptor langerin (2021) (5)
Target Recognition in Tandem WW Domains: Complex Structures for Parallel and Antiparallel Ligand Orientation in h-FBP21 Tandem WW (2021) (4)
Iodine-Mediated Tryptathionine Formation Facilitates the Synthesis of Amanitins. (2021) (4)
A review of Girsanov reweighting and of square root approximation for building molecular Markov state models (2022) (3)
Force field optimization by imposing kinetic constraints with path reweighting (2022) (3)
Markov State Models in Drug Design (2018) (2)
GROMACS Stochastic Dynamics and BAOAB Are Equivalent Configurational Sampling Algorithms. (2022) (2)
Correction to Kinetic Models of Cyclosporin A in Polar and Apolar Environments Reveal Multiple Congruent Conformational States. (2017) (1)
Modulation of a ligand's energy landscape and kinetics by the chemical environment. (2012) (1)
The occurrence of ansamers in the synthesis of cyclic peptides (2022) (1)
A Formylglycine‐Peptide for the Site‐Directed Identification of Phosphotyrosine‐Mimetic Fragments (2022) (1)
Molecular mechanism of the pH-dependent calcium affinity in langerin (2020) (1)
Fluorine-induced polarity increases inhibitory activity of BPTI towards chymotrypsin (2022) (1)
CommonNNClustering—A Python package for generic common-nearest-neighbour clustering (2022) (1)
Stable Isotopomers of myo-Inositol Uncover a Complex MINPP1-Dependent Inositol Phosphate Network (2022) (1)
Water Network in the Binding Pocket of Fluorinated BPTI-Trypsin Complexes - Insights from Simulation and Experiment (2022) (0)
Local elevation on the dihedral angles to improve the J-values (2007) (0)
Molecular Dynamics Simulations of Molecules under Confined Geometry: from Binary Mixture to Perfluorinated Polyphile Dissertation (2021) (0)
Girsanov reweighting for simulations of underdamped Langevin dynamics. Theory (2023) (0)
Publisher's Note: "Density-based cluster algorithms for the identification of core sets" [J. Chem. Phys. 145, 164104 (2016)]. (2016) (0)
Extended Peptide Basis Set for Variational Markov Models: Secondary Structure, Orthonormality, and Undersampled Transitions (2018) (0)
Pentafluorophosphato‐Phenylalanines: Amphiphilic Phosphotyrosine Mimetics Displaying Fluorine‐Specific Protein Interactions (2022) (0)
CARB 1 Chemical probes of glycan assembly in microbes (2018) (0)
Supplementary material for : The Vibrational Spectrum of the hydrated Alanine-Leucine Peptide in the Amide region from IR experiments and First Principles Calculations (2017) (0)
Grid-based state space exploration for molecular binding (2022) (0)
The influence of N-methylation on the ansamers of an amatoxin: Gly5Sar-amanullin (2022) (0)
Resolving the apparent gap in complexity between simulated and measured kinetics of biomolecules (2012) (0)
An intra-domain allosteric network modulates the calcium affinity of the C-type lectin receptor Langerin ” (2016) (0)
olerance of tubulin tyrosine ligase enables one-step site-speci fi c enzymatic protein labeling † (2017) (0)
Energy Landscape Analysis of the Full-Length SAM-I Riboswitch using Single-Molecule FRET Spectroscopy (2018) (0)
Algorithms for the analysis of biomolecular simulations (2009) (0)
Clustering - Basic concepts and methods (2022) (0)

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Bettina G. Keller's Academic­Influence.com Rankings