Automated Markov state models for molecular dynamics simulations of aggregation and self-assembly

Sengupta, Ushnish; Carballo Pacheco, Martin; Strodel, Birgit (Corresponding author)

Melville, NY : American Institute of Physics (2019)
Journal Article

In: The journal of chemical physics
Volume: 150
Issue: 11
Page(s)/Article-Nr.: 115101