Skip Nav Destination
Markov Models of Molecular Kinetics
Guest Editors Edina Rosta and Frank Noé worked in collaboration with JCP Editors Peter Hamm and John Straub on this Special Topic. Markov models are state-of-the-art data-based statistical models applied in this context to calculate the transition rates (molecular kinetics) and equilibrium thermodynamics of molecular conformational configurations of physicochemical systems. We hope you enjoy this snapshot of the field, which has flourished in the last decade and we feel is now ready for a topical collection.
Theoretical Methods and Algorithms
Eric R. Beyerle; Marina G. Guenza
10.1063/1.5123513
Theoretical Methods and Algorithms
Erik H. Thiede; Dimitrios Giannakis; Aaron R. Dinner; Jonathan Weare
10.1063/1.5063730
Theoretical Methods and Algorithms
Martin K. Scherer; Brooke E. Husic; Moritz Hoffmann; Fabian Paul; Hao Wu; Frank Noé
10.1063/1.5083040
Theoretical Methods and Algorithms
Bernhard Reuter; Konstantin Fackeldey; Marcus Weber
10.1063/1.5064530
Theoretical Methods and Algorithms
Fabian Paul; Hao Wu; Maximilian Vossel; Bert L. de Groot; Frank Noé
10.1063/1.5083627
Theoretical Methods and Algorithms
Giovanni Pinamonti; Fabian Paul; Frank Noé; Alex Rodriguez; Giovanni Bussi
10.1063/1.5083227
Theoretical Methods and Algorithms
Adam Kells; Zsuzsanna É. Mihálka; Alessia Annibale; Edina Rosta
10.1063/1.5083924
Biological Molecules and Networks
Debayan Chakraborty; David J. Wales
10.1063/1.5070152
Theoretical Methods and Algorithms
Lizhe Zhu; Fu Kit Sheong; Siqin Cao; Song Liu; Ilona C. Unarta; Xuhui Huang
10.1063/1.5082633
Theoretical Methods and Algorithms
Sina Jazani; Ioannis Sgouralis; Steve Pressé
10.1063/1.5083869
Biological Molecules and Networks
Ushnish Sengupta; Martín Carballo-Pacheco; Birgit Strodel
10.1063/1.5083915
Theoretical Methods and Algorithms
Marco Bacci; Amedeo Caflisch; Andreas Vitalis
10.1063/1.5063556
Theoretical Methods and Algorithms
Lin Qin; Christoph Dellago; Ernst Kozeschnik
10.1063/1.5080933
Theoretical Methods and Algorithms
Daniel Nagel; Anna Weber; Benjamin Lickert; Gerhard Stock
10.1063/1.5081767
Theoretical Methods and Algorithms
Irina V. Gopich; Attila Szabo
10.1063/1.5079748
Theoretical Methods and Algorithms
Naoyuki Karasawa; Ayori Mitsutake; Hiroshi Takano
10.1063/1.5083891
Theoretical Methods and Algorithms
Purushottam D. Dixit; Ken A. Dill
10.1063/1.5086681
Theoretical Methods and Algorithms
Alexander M. Berezhkovskii; Attila Szabo
10.1063/1.5079742
Theoretical Methods and Algorithms
Fabian Knoch; Thomas Speck
10.1063/1.5055818