Fluctuations, Finite-Size Effects and the Thermodynamic Limit in Computer Simulations: Revisiting the Spatial Block Analysis Method

por Heidari, Maziar, Kremer, Kurt, Potestio, Raffaello, Cortes-Huerto, Robinson
Publicado 2018

Investigating the Conformational Ensembles of Intrinsically Disordered Proteins with a Simple Physics-Based Model

por Zhao, Yani, Cortes-Huerto, Robinson, Kremer, Kurt, Rudzinski, Joseph F.
Publicado 2020

From adaptive resolution to molecular dynamics of open systems

por Cortes-Huerto, Robinson, Praprotnik, Matej, Kremer, Kurt, Delle Site, Luigi
Publicado 2021

Water Harvesting by Thermoresponsive Ionic Liquids: A Molecular Dynamics Study of the Water Absorption Kinetics and of the Role of Nanostructuring

por Forero-Martinez, Nancy C., Cortes-Huerto, Robinson, Ward, Lainey, Ballone, Pietro
Publicado 2023

Thermoresponsive Ionic Liquid/Water Mixtures: From Nanostructuring to Phase Separation

por Forero-Martinez, Nancy C., Cortes-Huerto, Robinson, Benedetto, Antonio, Ballone, Pietro
Publicado 2022

Stabilizing α-Helicity of a Polypeptide in Aqueous Urea: Dipole Orientation or Hydrogen Bonding?

por Baptista, Luis A., Zhao, Yani, Kremer, Kurt, Mukherji, Debashish, Cortes-Huerto, Robinson
Publicado 2023

Chilling alcohol on the computer: isothermal compressibility and the formation of hydrogen-bond clusters in liquid propan-1-ol

por Baptista, Luis A., Sevilla, Mauricio, Wagner, Manfred, Kremer, Kurt, Cortes-Huerto, Robinson
Publicado 2023

Why Do Elastin-Like Polypeptides Possibly Have Different Solvation Behaviors in Water–Ethanol and Water–Urea Mixtures?

por Zhao, Yani, Singh, Manjesh K., Kremer, Kurt, Cortes-Huerto, Robinson, Mukherji, Debashish
Publicado 2020