Last most-relevant publications
- Surviving the deluge of biosimulation data Wiley Interdisciplinary Reviews: WIREs Comput Mol Sci
- The Origins and the Biological Consequences of the Pur/Pyr DNA·RNA Asymmetry Chem
- Oncogenic mutations at the EGFR ectodomain structurally converge to remove a steric hindrance on a kinase-coupled cryptic epitope Proceedings of the National Academy of Sciences
- An In-Depth Look at DNA Crystals through the Prism of Molecular Dynamics Simulations Chem
Prediction and validation of protein intermediate states from structurally rich ensembles and coarse-grained simulations
Multiscale simulation of DNA
DNA is not only among the most important molecules in life, but a meeting point for biology, physics and chemistry, being studied by numerous techniques. Theoretical methods can help in gaining a detailed understanding of DNA structure and function, but their practical use is hampered by the multiscale nature of this molecule.