Bettina G Keller (B G Keller)

ResearcherID ORCID

Publication Activity (10 Years)

Years Active: 2018-2024
Publications (10 Years): 16

Top Topics

Single Molecule

Top Venues

The journal of physical chemistry. B

Journal of chemical information and modeling

RSC chemical biology

The Journal of chemical physics

This page only lists publications with an associated author ORCID identifier.

Publications

Leon Wehrhan, Bettina G Keller
Fluorinated Protein-Ligand Complexes: A Computational Perspective. The journal of physical chemistry. B 128 (25) (2024)
Joana-Lysiane Schäfer, Bettina G Keller
Implementation of Girsanov Reweighting in OpenMM and Deeptime. The journal of physical chemistry. B 128 (25) (2024)
Leon Wehrhan, Bettina G Keller
Prebound State Discovered in the Unbinding Pathway of Fluorinated Variants of the Trypsin-BPTI Complex Using Random Acceleration Molecular Dynamics Simulations. Journal of chemical information and modeling 64 (13) (2024)
Leon Wehrhan, Bettina G Keller
Prebound State Discovered in the Unbinding Pathway of Fluorinated Variants of the Trypsin-BPTI Complex Using Random Acceleration Molecular Dynamics Simulations. Journal of chemical information and modeling 64 (13) (2024)
Leon Wehrhan, Bettina G Keller
Prebound State Discovered in the Unbinding Pathway of Fluorinated Variants of the Trypsin-BPTI Complex Using Random Acceleration Molecular Dynamics Simulations. Journal of chemical information and modeling 64 (13) (2024)
Joana-Lysiane Schäfer, Bettina G Keller
Implementation of Girsanov Reweighting in OpenMM and Deeptime. The journal of physical chemistry. B 128 (25) (2024)
Leon Wehrhan, Bettina G Keller
Prebound State Discovered in the Unbinding Pathway of Fluorinated Variants of the Trypsin-BPTI Complex Using Random Acceleration Molecular Dynamics Simulations. Journal of chemical information and modeling (2024)
Leon Wehrhan, Bettina G Keller
Fluorinated Protein-Ligand Complexes: A Computational Perspective. The journal of physical chemistry. B 128 (25) (2024)
Joana-Lysiane Schäfer, Bettina G Keller
Implementation of Girsanov Reweighting in OpenMM and Deeptime. The journal of physical chemistry. B 128 (25) (2024)
Leon Wehrhan, Bettina G Keller
Fluorinated Protein-Ligand Complexes: A Computational Perspective. The journal of physical chemistry. B 128 (25) (2024)
Leon Wehrhan, Bettina G Keller
Fluorinated Protein-Ligand Complexes: A Computational Perspective. The journal of physical chemistry. B (2024)
Joana-Lysiane Schäfer, Bettina G Keller
Implementation of Girsanov Reweighting in OpenMM and Deeptime. The journal of physical chemistry. B (2024)
Maximilian Müll, Farzaneh Pourmasoumi, Leon Wehrhan, Olena Nosovska, Philipp Stephan, Hannah Zeihe, Ivan Vilotijevic, Bettina G Keller, Hajo Kries
Biosynthetic incorporation of fluorinated amino acids into the nonribosomal peptide gramicidin S. RSC chemical biology 4 (9) (2023)
Jakob Leppkes, Nicole Dimos, Bernhard Loll, Thomas Hohmann, Michael Dyrks, Ariane Wieseke, Bettina G Keller, Beate Koksch
Fluorine-induced polarity increases inhibitory activity of BPTI towards chymotrypsin. RSC chemical biology 3 (6) (2022)
S Kieninger, Bettina G Keller
Path probability ratios for Langevin dynamics-Exact and approximate. The Journal of chemical physics 154 (9) (2021)
Luca Donati, Bettina G Keller
Girsanov reweighting for metadynamics simulations. The Journal of chemical physics 149 (7) (2018)