Author

Andrea Volkamer

2 papers indexed here

We haven’t gathered this author’s papers yet. Follow them and we’ll fetch their work.

Not the right person? Other researchers publish under this name.

Open access Oct 2026

Subpocket-Aware Fragment-Based Docking Pipeline for Kinase Ligand Design: Methodology and a PKA Case Study

Protein kinases regulate signal transduction through phosphorylation, and their dysregulation drives diseases like cancer, autoimmune disorders, and Alzheimer’s, making them key drug targets. Fragment-based drug design offers a powerful route to kinase inhibitors but often neglects kinase-specific structural insights....

Katharina Buchthal, Paula Linh Kramer, Dominik Hubach et al. · Journal of Chemical Informat... · 0 citations

Open access Sep 2026

Data driven selection of consensus docking pipelines for structure based hit identification

MolDockLab addresses the challenge of structure-based virtual screening with an automated, data-driven framework that optimizes SBVS workflows for a protein target, balancing predictive performance and computational efficiency.

Hamza Agha, Y. Ibrahim, Michael Backenköhler et al. · npj Drug Discovery · 0 citations