Input parameter files and parts of the resulting trajectories for a POPC bilayer simulation with varying water-to-lipid ratios. The used ratios are 50, 25, 20, 15, 10, and 5. The force field is an ext
Here we report on the temperature dependence of the anomalous behaviour of water in terms of (i) its growth in tetrahedral structures, (ii) instantaneous spatial correlations from small angle x-ray sc
GROMOS 53A6 based atomistic force field for the conjugated polymer P3HT, the fullerene derivative PCBM and chlorobenzene.The provided files are in GROMACS format (see GROMACS manual and tutorial in ca
