Frauke Gräter

17 papers A* 2Journal 15
YearRankTypeTitle / Venue / Authors
2025 J jnl
ColBuilder: flexible structure generation of crosslinked collagen fibrils.
Bioinform.
Debora Monego, Matthias Brosz, Johanna Buck, Vsevolod Viliuga, Paulius Greicius, Jaewoon Jung, Torsten Stuehn, Matthias Schmies, Yuji Sugita, Frauke Gräter
2025 J jnl
Flexibility-Conditioned Protein Structure Design with Flow Matching.
CoRR
Vsevolod Viliuga, Leif Seute, Nicolas Wolf, Simon Wagner, Arne Elofsson, Jan Stühmer, Frauke Gräter
2025 A* conf
Flexibility-conditioned protein structure design with flow matching.
ICML
Vsevolod Viliuga, Leif Seute, Nicolas Wolf, Simon Wagner, Arne Elofsson, Jan Stühmer, Frauke Gräter
2025 J jnl
Learning Potential Energy Surfaces of Hydrogen Atom Transfer Reactions in Peptides.
CoRR
Marlen Neubert, Patrick Reiser, Frauke Gräter, Pascal Friederich
2025 J jnl
Learning conformational ensembles of proteins based on backbone geometry.
CoRR
Nicolas Wolf, Leif Seute, Vsevolod Viliuga, Simon Wagner, Jan Stühmer, Frauke Gräter
2024 A* conf
Generating Highly Designable Proteins with Geometric Algebra Flow Matching.
NeurIPS
Simon Wagner, Leif Seute, Vsevolod Viliuga, Nicolas Wolf, Frauke Gräter, Jan Stühmer
2024 J jnl
Generating Highly Designable Proteins with Geometric Algebra Flow Matching.
CoRR
Simon Wagner, Leif Seute, Vsevolod Viliuga, Nicolas Wolf, Frauke Gräter, Jan Stühmer
2024 J jnl
Grappa - A Machine Learned Molecular Mechanics Force Field.
CoRR
Leif Seute, Eric Hartmann, Jan Stühmer, Frauke Gräter
2023 J jnl
Mechanical forces control the valency of the malaria adhesin VAR2CSA by exposing cryptic glycan binding sites.
PLoS Comput. Biol.
Rita Roessner, Nicholas Michelarakis, Frauke Gräter, Camilo Aponte-Santamaría
2021 J jnl
How multisite phosphorylation impacts the conformations of intrinsically disordered proteins.
PLoS Comput. Biol.
Fan Jin, Frauke Gräter
2015 J jnl
Dynamic Allostery of the Catabolite Activator Protein Revealed by Interatomic Forces.
PLoS Comput. Biol.
Maxime Louet, Christian Seifert, Ulf Hensen, Frauke Gräter
2015 J jnl
Mechanism of Focal Adhesion Kinase Mechanosensing.
PLoS Comput. Biol.
Jing Zhou, Camilo Aponte-Santamaría, Sebastian Sturm, Jakob Tómas Bullerjahn, Agnieszka Bronowska, Frauke Gräter
2014 J jnl
An Allosteric Signaling Pathway of Human 3-Phosphoglycerate Kinase from Force Distribution Analysis.
PLoS Comput. Biol.
Zoltan Palmai, Christian Seifert, Frauke Gräter, Erika Balog
2013 J jnl
Evolutionary Optimization of Protein Folding.
PLoS Comput. Biol.
Cédric Debès, Minglei Wang, Gustavo Caetano-Anollés, Frauke Gräter
2012 J jnl
Dynamic Prestress in a Globular Protein.
PLoS Comput. Biol.
Scott A. Edwards, Johannes A. Wagner, Frauke Gräter
2009 J jnl
Dynamic Allostery in the Methionine Repressor Revealed by Force Distribution Analysis.
PLoS Comput. Biol.
Wolfram Stacklies, Fei Xia, Frauke Gräter
2009 J jnl
Mechanical Network in Titin Immunoglobulin from Force Distribution Analysis.
PLoS Comput. Biol.
Wolfram Stacklies, M. Cristina Vega, Matthias Wilmanns, Frauke Gräter