Simulations comparing aluminum oxide models with differing amounts of corrugation demonstrate the significance of hydroxyl ...
Chlorine is an essential industrial chemical used in products ranging from disinfectants to plastics. Yet producing chlorine ...
A collaboration between the groups of Professor Mónica H. Pérez-Temprano at the Institute of Chemical Research of Catalonia ...
The authors present an important multi-scale computational platform, which aims to automate the workflow for coarse-grained simulations of biomolecules in the framework of the popular MARTINI model.