Iris Antes

Garching Bei Munchen, BY, Germany

Last Updated: 09/26/2026

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Found 44 publications

Benchmarking biomolecular force field-based Zn2+ for mono- and bimetallic ligand binding sites.

Benchmarking biomolecular force field-based Zn2+ for mono- and bimetallic ligand binding sites.

Journal: Journal of computational chemistry

Published: September 15, 2022

Dynamic Docking of Macrocycles in Bound and Unbound Protein Structures with DynaDock.

Dynamic Docking of Macrocycles in Bound and Unbound Protein Structures with DynaDock.

Journal: Journal of chemical information and modeling

Published: July 07, 2022

Distinct conformational and energetic features define the specific recognition of (di)aromatic peptide motifs by PEX14.

Distinct conformational and energetic features define the specific recognition of (di)aromatic peptide motifs by PEX14.

Journal: Biological chemistry

Published: May 08, 2022

Comparison of allosteric signaling in DnaK and BiP using mutual information between simulated residue conformations.

Comparison of allosteric signaling in DnaK and BiP using mutual information between simulated residue conformations.

Journal: Proteins

Published: March 30, 2022

Structure-Guided Modulation of the Catalytic Properties of [2Fe-2S]-Dependent Dehydratases.

Structure-Guided Modulation of the Catalytic Properties of [2Fe-2S]-Dependent Dehydratases.

Journal: Chembiochem : a European journal of chemical biology

Published: February 09, 2022

The Q41R mutation in the HCV-protease enhances the reactivity towards MAVS by suppressing non-reactive pathways.

The Q41R mutation in the HCV-protease enhances the reactivity towards MAVS by suppressing non-reactive pathways.

Journal: Physical chemistry chemical physics : PCCP

Published: January 14, 2022

Investigation of the pH-dependent aggregation mechanisms of GCSF using low resolution protein characterization techniques and advanced molecular dynamics simulations.

Investigation of the pH-dependent aggregation mechanisms of GCSF using low resolution protein characterization techniques and advanced molecular dynamics simulations.

Journal: Computational and structural biotechnology journal

Published: December 15, 2021

Functional analysis of peripheral and intratumoral neoantigen-specific TCRs identified in a patient with melanoma.

Functional analysis of peripheral and intratumoral neoantigen-specific TCRs identified in a patient with melanoma.

Journal: Journal for immunotherapy of cancer

Published: August 03, 2021

SenseNet, a tool for analysis of protein structure networks obtained from molecular dynamics simulations.

SenseNet, a tool for analysis of protein structure networks obtained from molecular dynamics simulations.

Journal: PloS one

Published: July 16, 2021

DynaBiS: A hierarchical sampling algorithm to identify flexible binding sites for large ligands and peptides.

DynaBiS: A hierarchical sampling algorithm to identify flexible binding sites for large ligands and peptides.

Journal: Proteins

Published: December 15, 2020

Broad spectrum antibiotic-degrading metallo-β-lactamases are phylogenetically diverse.

Broad spectrum antibiotic-degrading metallo-β-lactamases are phylogenetically diverse.

Journal: Protein & cell

Published: June 17, 2020

Extended interaction networks with HCV protease NS3-4A substrates explain the lack of adaptive capability against protease inhibitors.

Extended interaction networks with HCV protease NS3-4A substrates explain the lack of adaptive capability against protease inhibitors.

Journal: The Journal of biological chemistry

Published: April 16, 2020

Showing 1-12 of 44

Last Updated: 09/26/2026