Published February 10, 2022
| Version v2
Dataset
Open
Project files provided as supporting information to the manuscript "Coarse-grained Mori-Zwanzig dynamics in a time-non-local stationary-action framework"
Authors/Creators
- 1. University of Trento
Description
Project files provided as supporting information to the manuscript "Coarse-grained Mori-Zwanzig dynamics in a time-non-local stationary-action framework"
GLE Optimization: Optimizator of GLE parameters. Uses Matlab
MD_GLE: CG GLE and LE simulator. Uses Matlab
Water_simulation: Folders for atomistic water system simulation with GROMACS. It requires to be run on Linux with GROMACS
and VOTCA packages installed.
Notes
RP acknowledges support from the Italian Ministry of Education, University and Research (MIUR) through the FARE grant for the project HAMMOCK (Grant R18ZHWY3NC).