Daria B Kokh

11PUBLICATIONS
21CO-AUTHORS
Proteomics and intermolecular interactions (excl. medical proteomics)Environmental epidemiologyElectrical energy generation (incl. renewables, excl. photovoltaics)Pharmaceutical delivery technologiesBiomolecular modelling and design
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Publications (11)

|Sep 17, 2024
Computational screening of the effects of mutations on protein-protein off-rates and dissociation mechanisms by τRAMD.

Giulia D'Arrigo, Daria B Kokh, Ariane Nunes-Alves

|Aug 02, 2023
Molecular Dynamics Simulations of the Human Ecto-5'-Nucleotidase (h-ecto-5'-NT, CD73): Insights into Protein Flexibility and Binding Site Dynamics.

Lucas G Viviani, Daria B Kokh, Rebecca C Wade

|Sep 22, 2022
Graphene BioFET sensors for SARS-CoV-2 detection: a multiscale simulation approach.

A Toral-Lopez, D B Kokh, E G Marin

|Sep 08, 2021
G Protein-Coupled Receptor-Ligand Dissociation Rates and Mechanisms from τRAMD Simulations.

Daria B Kokh, Rebecca C Wade

|Sep 08, 2021
Contact Map Fingerprints of Protein-Ligand Unbinding Trajectories Reveal Mechanisms Determining Residence Times Computed from Scaled Molecular Dynamics.

Marc Bianciotto, Paraskevi Gkeka, Daria B Kokh

|Jun 17, 2021
A Blueprint for High Affinity SARS-CoV-2 Mpro Inhibitors from Activity-Based Compound Library Screening Guided by Analysis of Protein Dynamics.

Jonas Gossen, Simone Albani, Anton Hanke

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Frequent Collaborators

11 joint publications

Rebecca C Wade

2 joint publications

Marta Amaral

2 joint publications

Neil J Bruce

1 joint publications

P Matias