The dynamics of the RNA polymerase II (Pol II) backtracking process is poorly understood. Scientists have now built a Markov State Model from extensive molecular dynamics simulations to identify ...

Researchers have demonstrated that molecular dynamics ... models could be used to quickly predict which new chemical compounds could be promising drug candidates. Researchers from North Carolina ...

Molecular simulations ... can be compared to experiments? Markov state models are a way of analysing simulation trajectory data using a statistical framework. In this talk, I will introduce why ...