Andrea Volkamer

28PUBLICATIONS
76CO-AUTHORS
Electrical energy generation (incl. renewables, excl. photovoltaics)Cheminformatics and quantitative structure-activity relationshipsProteomics and metabolomicsMolecular targetsBiomolecular modelling and design
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Publications (28)

|Jun 06, 2026
Hit-to-Lead Optimization of Energy-Coupling Factor (ECF) Transporter Inhibitors as Novel Antibiotic.

|Mar 23, 2026
CustomKinFragLib: Filtering the Kinase-Focused Fragmentation Library.

Paula Linh Kramer, Katharina Buchthal, Dominique Sydow

|Mar 26, 2025
Deconstruction of Dual-Site Tankyrase Inhibitors Provides Insights into Binding Energetics and Suggests Critical Hotspots for Ligand Optimization.

Sven T Sowa, Murat Kücükdisli, Yelena Mostinski

|Mar 10, 2025
Prospective evaluation of structure-based simulations reveal their ability to predict the impact of kinase mutations on inhibitor binding.

Sukrit Singh, Vytautas Gapsys, Matteo Aldeghi

|Mar 07, 2025
Prospective Evaluation of Structure-Based Simulations Reveal Their Ability to Predict the Impact of Kinase Mutations on Inhibitor Binding.

Sukrit Singh, Vytautas Gapsys, Matteo Aldeghi

|Nov 19, 2024
Benchmarking Cross-Docking Strategies in Kinase Drug Discovery.

David A Schaller, Clara D Christ, John D Chodera

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Frequent Collaborators

8 joint publications

Dominique Sydow

5 joint publications

David Schaller

4 joint publications

John D Chodera

4 joint publications

Marc Nazaré