Markov State Models Reconcile Conformational Plasticity of GTPase

Markov State Models and Molecular Dynamics Simulations Reveal the Conformational Transition of the Intrinsically Disordered Hypervariable Region of K-Ras4B to the Ordered Conformation

Regulation of NADPH Oxidases

Markov state modeling reveals alternative unbinding pathways for peptide–MHC complexes

Drugging all RAS isoforms with one pocket

Award Winners and Abstracts of the 35th Anniversary Symposium of The Protein Society, July 7–14, 2021

Biomolecules, Free Full-Text

Markov state modeling reveals alternative unbinding pathways for peptide–MHC complexes

Issue: Biophysical Journal

Multiensemble Markov models of molecular thermodynamics and kinetics