Samuel Genheden
University of Southampton
1 paper in the Anchorcite directory, published in 2015, cited 5,668 times in total.
ORCID profileResearch topics
- Computational Drug Discovery Methods · 1 paper
- Protein Structure and Dynamics · 1 paper
- Protein Interaction Studies and Fluorescence Analysis · 1 paper
Frequent co-authors
- Ulf Ryde · 1 paper
Papers
- The MM/PBSA and MM/GBSA methods to estimate ligand-binding affinitiesExpert Opinion on Drug Discovery · 2015 · 5,668 citations
INTRODUCTION: The molecular mechanics energies combined with the Poisson-Boltzmann or generalized Born and surface area continuum solvation (MM/PBSA and MM/GBSA) methods are popular approaches to estimate the free energy of the binding of small ligands to biological macromolecules. They are…
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