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R Gregor Weiß

4PUBLICATIONS

11CO-AUTHORS

Computational chemistryPolymerisation mechanismsBiomolecular modelling and design

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Publications (4)

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|Jan 03, 2022

Relative free-energy calculations for scaffold hopping-type transformations with an automated RE-EDS sampling procedure.

Benjamin Ries, Karl Normak, R Gregor Weiß

|Aug 11, 2021

N-Glycosylation Enhances Conformational Flexibility of Protein Disulfide Isomerase Revealed by Microsecond Molecular Dynamics and Markov State Modeling.

R Gregor Weiß, Marie-Estelle Losfeld, Markus Aebi

|Jul 02, 2021

Glycan-protein interactions determine kinetics of <i>N</i>-glycan remodeling.

Corina Mathew, R Gregor Weiß, Christoph Giese

|May 12, 2017

Principles for Tuning Hydrophobic Ligand-Receptor Binding Kinetics.

R Gregor Weiß, Piotr Setny, Joachim Dzubiella

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Frequent Collaborators

3 joint publications

Sereina Riniker

1 joint publications

Piotr Setny

1 joint publications

Joachim Dzubiella

1 joint publications

Corina Mathew

1 joint publications

Chia-Wei Lin

1 joint publications

Benjamin Ries

1 joint publications

Karl Normak

1 joint publications

Salomé Rieder

1 joint publications

Emília P Barros

1 joint publications

Candide Champion

Frequent Collaborators

3 joint publications

Sereina Riniker

1 joint publications

Piotr Setny

1 joint publications

Joachim Dzubiella

1 joint publications

Corina Mathew

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